Seasonal variations in surface metabolite composition of Fucus vesiculosus and Fucus serratus sampled at outer Kiel Fjord (August 2012 - July 2013)


Autoria(s): Rickert, Esther; Wahl, Martin; Link, Heike; Richter, Hannes; Pohnert, Georg
Cobertura

LATITUDE: 54.455830 * LONGITUDE: 10.199160 * DATE/TIME START: 2012-08-01T00:00:00 * DATE/TIME END: 2013-07-31T00:00:00

Data(s)

26/09/2016

Resumo

The chemical composition of surface associated metabolites of two Fucus species (Fucus vesiculosus and Fucus serratus) was analysed by means of gas chromatography-mass spectrometry (GC-MS) to describe temporal patterns in chemical surface composition. Method: The two perennial brown macroalgae F. vesiculosus and F. serratus were sampled monthly at Bülk, outer Kiel Fjord, Germany (54°27'21 N / 10°11'57 E) over an entire year (August 2012 - July 2013). Per month and species six non-fertile Fucus individuals were collected from mixed stands at a depth of 0.5 m under mid water level. For surface extraction approx. 50 g of the upper 5-10 cm apical thalli tips were cut off per species. The surface extraction of Fucus was performed according to the protocol of de Nys and co-workers (1998) with minor modifications (see Rickert et al. 2015). GC/EI-MS measurements were performed with a Waters GCT premier (Waters, Manchester, UK) coupled to an Agilent 6890N GC equipped with a DB-5 ms 30 m column (0.25 mm internal diameter, 0.25 mM film thickness, Agilent, USA). The inlet temperature was maintained at 250°C and samples were injected in split 10 mode. He carrier gas flow was adjusted to 1 ml min-1. Alkanes were used for referencing of retention times. For further details (GC-MS sample preparation and analysis) see the related publication (Rickert et al. submitted to PLOS ONE).

Formato

application/zip, 2 datasets

Identificador

https://doi.pangaea.de/10.1594/PANGAEA.864960

Idioma(s)

en

Publicador

PANGAEA

Direitos

Access constraints: access rights needed

Fonte

Supplement to: Rickert, Esther; Wahl, Martin; Link, Heike; Richter, Hannes; Pohnert, Georg: Seasonal variations in surface metabolite composition of Fucus vesiculosus and Fucus serratus from the Baltic Sea. PLoS ONE

Palavras-Chave #-1(25.7786,Unknown); -1(26.7746,Unknown); 101(20.071,Unknown); 103.06(11.308,M000469_A149002-101-xxx_NA_1485,23_TRUE_VAR5_ALK_Threitol (4TMS)); 103.06(6.022,Unknown); 103.1(10.3462,??? 2,4-Bishydroxybutanoic acid (3TMS)); 103.1(10.3505,??? Glycerol (3TMS)); 103.1(12.7728,Xylose methoxyamine (4TMS)); 103.1(12.8373,Xylose methoxyamine (4TMS)); 103.1(12.8931,Xylose methoxyamine (4TMS)); 103.1(14.7473,Psicose methoxyamine (5TMS)); 103.1(14.8061,? Psicose methoxyamine {BP} (5TMS)); 103.1(21.8945,??? Glucopyranose (5TMS)); 103.1(23.2563,Unknown); 105.1(27.3597,Unknown); 107.1(24.6418,Unknown); 108(18.3399,Unknown); 109.1(18.7704,Unknown); 109.1(20.3671,Unknown); 109.1(21.112,Unknown); 109.1(23.3932,Unknown); 111.1(23.6333,Unknown); 112.1(16.525,??? EITTMS_N12C_ATHR_2551.4_1135EC44_); 113.1(22.9438,??? EITTMS_N12C_ATHR_1234.3_1135EC44_); 115.06(5.608,Unknown); 115.06(5.668,Pentane, 2-methyl-4-keto-2-trimethylsiloxy-); 116.09(6.483,l-Alanine, N-(trimethylsilyl)-, trimethylsilyl ester); 116.1(21.3188,Unknown); 116.1(6.4079,?? Alanine (2TMS)); 116.1(6.4145,?? Alanine (2TMS)); 116.1(6.4516,? Alanine (2TMS)); 116.1(6.5001,? Alanine (2TMS)); 117.04(16.717,Heptadecanoic acid (1TMS)); 117.07(11.835,Unknown); 117.07(8.279,3,6,9-Trioxa-2,10-disilaundecane, 2,2,10,10-tetramethyl-); 117.1(11.841,?? Glycerol (3TMS)); 117.1(13.4064,??? Rhamnose methoxyamine (4TMS)); 117.1(13.6054,??? Rhamnose methoxyamine (4TMS)); 117.1(14.2446,?? Glucaric acid (6TMS)); 117.1(14.3549,Galactaric acid (6TMS)); 117.1(18.1834,Unknown); 117.1(5.0857,??? 4-Hydroxybutanoic acid (2TMS)); 117.1(5.3485,??? Fucose methoxyamine (4TMS)); 117.1(5.5946,Unknown); 117.1(5.6029,??? EITTMS_N12C_STUT_1719.1_1135EC30_); 117.1(5.9033,??? 4-Hydroxybutanoic acid (2TMS)); 117.1(5.9226,??? 4-Hydroxybutanoic acid (2TMS)); 117.1(8.2827,?? EITTMS_N12C_ATHR_2551.4_1135EC44_); 117.1(9.578,??? Threonic acid (4TMS)); 117(15.0519,?? Pentadecanoic acid (1TMS)); 117(15.2833,??? Glucose methoxyamine (5TMS)); 117(17.6594,? Octadecanoic acid (1TMS)); 117(20.4306,??? Melezitose (11TMS)); 117(9.6665,? Nonanoic acid (1TMS)); 118.1(5.9263,??? 4-Hydroxybutanoic acid (2TMS)); 121.04(6.035,Unknown); 123.12(14.436,C20H40O); 125.04(6.893,Furan-2-carboxylic acid (1TMS)); 125.06(12.259,Pimelic acid, bis(trimethylsilyl)-, ester (Heptanedioic acid)); 125.1(20.1437,Unknown); 128.06(17.405,Unknown); 128.1(17.3919,Unknown); 129.04(16.159,Hexadecanoic acid tms); 129.04(20.36,Docosanoic acid, trimethylsilyl ester); 129.1(24.5935,?? EITTMS_N12C_NTAR_3390.2_1135EC27_S); 129.1(24.7517,Unknown); 130.1(6.012,Unknown); 130.1(8.4072,??? Maleic acid (2TMS)); 131.1(5.6106,??? EITTMS_N12C_STUT_1719.1_1135EC30_); 131.1(7.5766,??? Maleic acid (2TMS)); 131(17.945,Unknown); 131(18.6496,Unknown); 131(19.1077,Unknown); 131(20.3371,Unknown); 131(20.6138,Unknown); 131(20.7577,Unknown); 131(22.2526,Unknown); 131(22.6936,Unknown); 131(22.8105,Unknown); 131(23.0478,Unknown); 131(23.1523,Unknown); 131(24.0938,Unknown); 131(25.042,Unknown); 131(25.8762,Unknown); 131(26.19,Unknown); 131(27.3101,Unknown); 131(27.8815,Unknown); 131(27.9782,Unknown); 131(28.2781,Unknown); 131(28.3316,Unknown); 131(28.6907,Unknown); 131(28.9004,Unknown); 131(29.2011,??? Trishydroxybenzene (3TMS)); 131(29.83,Unknown); 132.9(15.3133,Unknown); 132(21.8116,??? 5-Aminocarboxy-4,6-dihydroxypyrimidine); 133.05(6.593,Tris(trimethylsilyl)hydroxylamine); 133.1(6.5993,??? beta-Alanine (3TMS)); 133.1(6.6006,??? beta-Alanine (3TMS)); 133.1(6.9798,??? Maleic acid (2TMS)); 133(25.1722,Unknown); 133(27.5998,Unknown); 134(15.306,??? Galactitol (6TMS)); 135.1(23.3728,??? EITTMS_N12C_ATHR_1476.1_1135EC06_[Contamination]); 136.1(5.436,Unknown); 140.04(5.204,Unknown); 140(5.1964,Unknown); 141.9(24.6849,Unknown); 142.1(8.933,Proline (2 TMS)); 144.1(7.9342,Norvaline (2TMS)); 144.12(7.928,Unknown); 145.1(17.4626,??? 9-(Z)-Octadecenoic acid (1TMS)); 145.1(20.0466,Unknown); 145.1(7.705,Pentanoic acid, 2-[(trimethylsilyl)oxy]-, trimethylsilyl ester); 146.08(16.243,Unknown); 148.1(18.6917,??? EITTMS_N12C_ATHR_2396.9_1135EC44_); 148.1(28.1538,Unknown); 148.1(7.0421,??? Succinic acid (2TMS)); 148.1(9.1296,Succinic acid (2TMS)); 149.02(14.65,Dibutyl phthalate); 149.03(19.692,Unknown); 149(13.5205,? Xylitol (5TMS)); 150.08(5.434,Unknown); 150(23.8735,Unknown); 150(29.4963,Unknown); 151.01(16.774,Unknown); 151.07(7.484,2-(2-Methyl-propenyl)-cyclohexanone); 151(16.7663,Unknown); 152.1(5.5702,Unknown); 154.9(6.5342,??? EITTMS_N12C_STUT_1549.0_1135EC30_[NA]); 156.05(7.928,Unknown); 156.1(11.398,L-Proline, 5-oxo-1-(trimethylsilyl)-, trimethylsilyl ester : Pyroglutamic acid 2TMS); 156.1(11.4119,Pyroglutamic acid (2TMS)); 156.1(11.4196,Pyroglutamic acid (2TMS)); 156.1(25.3531,Unknown); 156.11(14.613,Unknown); 156.14(16.83,Unknown); 157.1(24.6185,Unknown); 158.08(10.172,Glutaric acid (tms)); 159.1(8.0538,??? EITTMS_N12C_STUT_1614.2_1135EC30_D1); 159.1(8.0568,??? EITTMS_N12C_STUT_1614.2_1135EC30_D1); 159.12(8.052,Unknown); 160.03(5.274,Unknown); 160.1(15.1102,Gulose methoxyamine {BP} (5TMS)); 160.1(7.9846,??? Xylose methoxyamine (4TMS)); 160.1(9.8003,Unknown); 160(5.2714,??? 2-Methyl-2-butenedioic acid (2TMS)); 160(9.7318,??? 2-Methyl-2-butenedioic acid (2TMS)); 166.99(17.158,Unknown); 166.99(18.126,Unknown); 166.99(18.323,Unknown); 167.08(5.558,Pyridine, 3-trimethylsiloxy); 167.09(18.664,Unknown); 167(17.1645,Unknown); 167(17.4072,Unknown); 167(17.4256,Unknown); 167(18.1621,Unknown); 168(17.2193,Unknown); 169(22.1896,Unknown); 169(28.4745,Unknown); 170.1(11.308,Adipo-2,6-lactam (2TMS); 170.1(11.678,Adipo-2,6-lactam (2TMS)); 170.14(5.538,Unknown); 172.08(16.53,l-Valine, N-butoxycarbonyl-, tridecyl ester); 173.07(7.073,Unknown); 173.1(23.3828,Unknown); 173.1(5.6881,??? EITTMS_N12C_STUT_1719.1_1135EC30_); 173.1(6.065,Hexanoic acid (1TMS)); 173.1(6.0762,??? EITTMS_N12C_STUO_2898.6_1135EC12_C17); 174.1(10.1858,? EITTMS_N12C_STUO_2898.6_1135EC12_C17); 174.1(10.758,??? 5-Aminovaleric acid (3TMS)); 174.1(10.7638,??? 5-Aminovaleric acid (3TMS)); 174.1(5.851,Phthalimide, N-isopropyl-); 174.1(7.1032,? Ethanolamine (3TMS)); 174.1(8.5387,?? Ethanolamine (3TMS)); 174.1(8.542,? Ethanolamine (3TMS)); 174.1(9.0608,Glycine (3TMS)); 174.11(8.536,Unknown); 174.12(10.483,Unknown); 174.12(7.108,Unknown); 174.12(9.033,Glycine, N,N-bis(trimethylsilyl)-, trimethylsilyl ester); 175.1(15.751,? Mannitol (6TMS)); 175.1(15.8102,? Galactitol (6TMS)); 175.1(15.8222,? Mannitol (6TMS)); 175.1(6.0294,Unknown); 177.04(7.471,Unknown); 177.08(6.125,Acetic acid, [(trimethylsilyl)oxy]-, trimethylsilyl ester); 177.08(7.03,1,4-Butanediol bis(trimethylsilyl)ether); 179.05(8.322,Benzoic acid trimethylsilyl ester); 180.05(8.933,Benzeneacetic acid, trimethylsilyl ester); 181.07(5.584,Unknown); 181.1(18.647,Methyl 9,12-epithio-9,11-octadecanoate); 184.04(9.324,2,5-Furandicarboxylic acid); 184(9.3297,??? EITTMS_N12C_ATHR_1358.9_1135EC06_); 185.1(17.131,Unknown); 186.06(6.095,Unknown); 186.09(8.616,M000029_A159001-101-xxx_NA_1583,16_TRUE_VAR5_ALK_Proline [+CO2] ); 186.1(6.122,??? Maleic acid (2TMS)); 186.1(8.6202,??? Proline (2TMS)); 186.1(8.8446,Unknown); 186.13(6.332,Unknown); 186(9.3424,Unknown); 187.1(15.4309,Unknown); 187.1(7.349,??? Suberic acid (2TMS)); 187.12(7.337, Heptanoic acid, n- (1TMS)); 188.1(9.6992,Unknown); 189.05(16.313,2-Amino-4-cyanomethyl-6-piperidino-1,3,5-triazine); 189.1(10.019,Unknown); 189.1(9.761,Unknown); 191.08(5.828,Propanoic acid, 2-[(trimethylsilyl)oxy]-, trimethylsilyl ester (Lactic acid)); 191.08(5.9,Propanoic acid, 2-[(trimethylsilyl)oxy]-, trimethylsilyl ester (Lactic acid)); 191.1(10.116,Unknown); 191.1(10.1651,??? EITTMS_N12C_STUL_2790.2_1135EC28_G); 191.1(10.1664,??? EITTMS_N12C_STUL_2790.2_1135EC28_G); 191(24.1338,Unknown); 191(27.4466,Unknown); 192.1(13.004,Unknown); 192(22.4343,Unknown); 194(29.1056,Unknown); 197.06(15.131,Unknown); 197.1(5.2148,Unknown); 198.1(6.4035,Unknown); 198.6(26.4345,Unknown); 199.12(17.097,Unknown); 201.1(8.5347,??? EITTMS_N12C_ATHR_1442.5_1135EC44_); 201.13(7.22,2-Ethylhexanoic acid, trimethylsilyl ester); 201.13(7.27,2-Ethylhexanoic acid, trimethylsilyl ester); 201.13(8.533,Octanoic acid, trimethylsilyl ester); 203.1(16.129,Unknown); 204.1(16.4408,? EITTMS_N12C_ATHR_1967.6_1135EC44_G); 204.1(16.4421,?? 1-Methyl-alpha-D-glucopyranoside (4TMS)); 204.1(17.726,Unknown); 204.1(17.846,2-O-Glycerol-à -d-galactopyranoside, hexa-TMS); 204.1(18.139,Unknown); 204.1(18.183,Unknown); 204.1(18.24,Unknown); 204.1(18.2586,??? EITTMS_N12C_ATHR_2614.7_1135EC44_); 204.1(18.2641,??? EITTMS_N12C_ATHR_1967.6_1135EC44_G); 204.1(18.33,Unknown); 204.1(20.897,Unknown); 204.1(21.132,Unknown); 204.1(21.4089,??? Glucopyranose (5TMS)); 204.1(21.869,M000000_A287007-101-xxx_NA_2866,73_PRED_VAR5_ALK_NA); 204.1(21.8922,?? EITTMS_N12C_STUT_2832.4_1135EC30_); 204.1(28.41,Unknown); 204.1(6.4877,??? EITTMS_N12C_ATHR_2614.7_1135EC44_); 204.11(17.956,Unknown); 204.11(28.81,Unknown); 204(15.2552,??? EITTMS_N12C_STUF_1968.0_1135EC32_G); 205.07(11.695,Cinnamic acid, trimethylsilyl ester); 205.1(10.5353,? EITTMS_N12C_ATHR_1442.5_1135EC44_); 205.1(11.3288,Threitol (4TMS)); 205.1(13.0398,?? Erythrose methoxyamine {BP} (3TMS)); 205.1(14.6821,??? EITTMS_N12C_ATHR_1744.9_1135EC44_B5); 205.1(14.9547,Idose methoxyamine (5TMS)); 205.1(15.141,Unknown); 205.1(20.9086,??? EITTMS_N12C_ATHR_1967.6_1135EC44_G); 205.1(21.9038,??? Isomaltose methoxyamine (8TMS)); 205.1(8.7124,Glycerol (3TMS)); 205.11(8.693,Trimethylsilyl ether of glycerol); 205.2(11.2671,??? Glycerol (3TMS)); 205.2(11.2714,??? Erythrose methoxyamine {BP} (3TMS)); 207.03(5.805,M000870_A104001-101-xxx_NA_1021,01_PRED_VAR5_ALK_Siloxane); 207.04(9.721,Unknown); 207(23.9349,Unknown); 207(24.44,Unknown); 207(25.6015,Unknown); 207(27.2072,Unknown); 207(27.2238,Unknown); 207(27.4886,Unknown); 207(5.8128,Unknown); 208.1(25.6781,Unknown); 208(25.6807,Unknown); 208(29.7502,Unknown); 210.1(7.6267,Unknown); 215.09(9.454,Itaconic acid (tms)); 215.1(9.283,Unknown); 215.15(9.658,Trimethylsilyl nonanoate); 216.2(24.7187,Unknown); 217.07(6.246,Pyruvic acid, bis(trimethylsilyl)-); 217.08(13.825,Unknown); 217.09(12.837,à -DL-Lyxofuranoside, methyl 2,3,5-tris-O-(trimethylsilyl)-); 217.1(11.3268,Threitol (4TMS)); 217.1(11.4056,Threitol (4TMS)); 217.1(12.2683,? EITTMS_N12C_ATHR_1770.9_1135EC25_); 217.1(12.2769,? EITTMS_N12C_ATHR_1770.9_1135EC25_); 217.1(13.3252,Xylitol (5TMS)); 217.1(13.4386,Xylitol (5TMS)); 217.1(14.8626,? Galactose methoxyamine (5TMS)); 217.1(15.0883,? Mannitol (6TMS)); 217.1(15.4105,?? Threitol (4TMS)); 217.1(15.5548,??? Galactitol (6TMS)); 217.1(15.6536,?? L(+)-Galactono-1,4-lactone (4TMS)); 217.1(16.1053,myo-Inositol (6TMS)); 217.1(16.2726,?? Threitol (4TMS)); 217.1(17.599,Unknown); 217.1(21.8825,Unknown); 217.11(11.388,Threitol, 1,2,3,4-tetrakis-O-(trimethylsilyl)-, D-); 217.11(12.777,Unknown); 217.11(12.904,d-Xylose, 2,3,4,5-tetrakis-O-(trimethylsilyl)-, O-methyloxime); 217.11(14.367,EITTMS_N12C_STUR_1832.7_1135EC29_); 217.11(14.767,D-Fructose, 1,3,4,5,6-pentakis-O-(trimethylsilyl)-, O-methyloxime); 217.11(9.26,Ethylmalonic acid, bis(trimethylsilyl) ester); 217(20.4649,??? EITTMS_N12C_STUO_1953.9_1135EC31_G); 218.1(15.5774,??? L(+)-Ascorbic acid (4TMS)); 220.16(11.271,Unknown); 220(21.0753,Unknown); 220(24.3981,Unknown); 220(24.9523,Unknown); 220(26.4011,Unknown); 221.09(8.018,3,6-Dioxa-2,4,5,7-tetrasilaoctane, 2,2,4,4,5,5,7,7-octamethyl-); 221.1(9.7235,??? trans-o-Coumaric acid (2TMS)); 221(17.2856,?? Mannitol (6TMS)); 225.1(6.6735,Unknown); 225.3(23.6766,Unknown); 226.13(12.667,Unknown); 228.1(11.2801,??? EITTMS_N12C_ATHR_1436.4_1135EC44_); 228.1(12.767,Unknown); 229.1(12.5327,Unknown); 229.1(13.6337,??? cis-Aconitic acid (3TMS)); 229.16(10.736,Trimethylsilyl decanoate); 231.09(14.701,D-Ribo-Hexitol, 3-deoxy-1,2,4,5,6-pentakis-O-(trimethylsilyl)-); 231.1(15.9789,??? Sorbitol (6TMS); Glucitol (6TMS)); 231.1(15.9819,??? Sorbitol (6TMS); Glucitol (6TMS)); 231.1(16.4558,??? EITTMS_N12C_ATHR_3088.4_1164CC65_); 231.1(20.4944,Unknown); 231.13(14.42,D-Ribo-Hexitol, 3-deoxy-1,2,4,5,6-pentakis-O-(trimethylsilyl)-); 234.1(11.055,EITTMS_N12C_ATHR_1480.5_1135EC44_); 234.1(5.8739,??? EITTMS_N12C_STUO_2898.6_1135EC12_C17); 234.12(11.034,Arabino-Hexos-2-ulose, 3,4,5,6-tetrakis-O-(trimethylsilyl)-, bis(dimethyl acetal)); 235.11(6.973,M000000_A114002-101-xxx_NA_1131,27_TRUE_VAR5_ALK_NA114002 (classified unknown)); 235.12(12.119,Cinnamic acid, m-methoxy-, trimethylsilyl ester); 237.09(21.445,Unknown); 237.1(11.3835,Unknown); 237.12(11.374,Unknown); 237.13(23.292,Tocopherol, alpha- (1TMS)); 237.17(18.567,Unknown); 237.17(18.861,Unknown); 239.11(10.917,Unknown); 239.18(18.74,M000000_A241004-101-xxx_NA_2418,77_PRED_VAR5_ALK_NA); 240.04(6.66,Unknown); 240.09(9.916,Unknown); 240.1(9.5246,??? Maleic acid (2TMS)); 240.1(9.5269,Unknown); 240.1(9.534,??? Maleic acid (2TMS)); 242.09(11.455,Unknown); 242.09(11.505,Unknown); 242.09(11.558,Unknown); 242(6.0515,Unknown); 243.09(10.539,Unknown); 243.1(10.116,Unknown); 243.18(11.751,Undecanoic acid (1TMS)); 243.21(11.908,Unknown); 244.1(11.435,Unknown); 245.07(9.534,2-Methylacetoacetic acid, di(trimethylsilyl) deriv.); 245.1(14.3108,??? Fumaric acid (2TMS)); 245.1(7.7775,? Fumaric acid (2TMS)); 245.1(9.5373,?? Maleic acid (2TMS)); 245.14(7.782,2-Penten-2,4-diol, 4-methyl-, bis(trimethylsilyl)ether); 246.1(14.597,Glutamic acid (3TMS)); 247.08(9.117,Succinic acid (2tms)); 247.1(10.9742,? Citramalic acid (3TMS)); 247.1(15.4753,??? Galactitol (6TMS)); 247.1(15.7939,Unknown); 247.1(9.8142,Threonic acid-1,4-lactone (2TMS), trans-); 248.1(10.4635,beta-Alanine (3TMS)); 252.14(12.61,Hydrocinnamic acid, p-(trimethylsiloxy)-, methyl ester); 255.1(9.695,Unknown); 257.2(12.724,Dodecanoic acid, trimethylsilyl ester (Lauric acid)); 257.2(24.7319,Unknown); 259.1(10.9729,?? 2-Methyl-2-butenedioic acid (2TMS)); 262.11(5.468,Unknown); 262.16(12.516,Unknown); 263.14(13.034,Gluconic acid, ç-lactone, 2-methoximine, tris(O-trimethylsilyl)-); 263.18(11.591,Unknown); 265(25.5397,Unknown); 268.06(8.833,Unknown); 271.21(13.642,Tridecanoic acid); 271.25(13.772,Unknown); 273.1(14.2997,Citric acid (4TMS)); 273(20.4439,?? Sucrose (8TMS)); 275.11(10.075,Unknown); 275.12(10.296,2-Methylglutaric acid, bis(trimethylsilyl)- ester); 275.12(11.254,Adipic acid (tms) (Hexanedioic acid)); 277.2(13.084,3,5-Di-tert-butyl-4-trimethylsiloxytoluene); 277.2(13.0849,Unknown); 278.13(9.695,Unknown); 279.18(12.987,Unknown); 281.05(10.98,Dodecamethylpentasiloxane); 281.05(7.437,Pentasiloxane, dodecamethyl-); 281.06(8.02,M000870_A123002-101-xxx_NA_1208,14_PRED_VAR5_ALK_similar to Pentasiloxane, dodecamethyl); 282.1(23.2742,Unknown); 282.1(27.1623,Unknown); 283.26(20.059,M000000_A260006-101-xxx_NA_2604,01_TRUE_VAR5_ALK_D260482); 283.3(20.058,Unknown); 285.2(14.5196,Tetradecanoic acid (1TMS)); 285.22(14.516,Tetradecanoic acid, trimethylsilyl ester); 285.23(14.202,Tetradecanoic acid, trimethylsilyl ester); 285.28(18.7,Unknown); 289.1(15.7808,Unknown); 289.13(10.797,Unknown); 292.1(11.7422,Erythronic acid (4TMS)); 292.1(11.9014,Erythronic acid (4TMS)); 292.1(13.8643,Pentonic acid (5TMS)); 292.1(13.9478,Pentonic acid (5TMS)); 292.1(9.4028,Glyceric acid (3TMS)); 292.13(11.74,Unknown); 292.13(11.888,THREONIC ACID,O,O,O,O-TMS (rythronic acid, tetrakis(trimethylsilyl) deriv. (2,3,4-Trihydroxybutyric acid))); 292.13(9.367,Glyceric acid (3TMS)); 292.14(15.879,Galactonic acid, 2,3,4,5,6-pentakis-O-(trimethylsilyl)-, trimethylsilyl ester); 293.1(11.8898,Erythronic acid (4TMS)); 295.08(13.077,Phthalic acid (tms)); 295.08(13.722,1,3-Benzenedicarboxylic acid, bis(trimethylsilyl) ester); 295.08(13.982,1,4-Benzenedicarboxylic acid, bis(trimethylsilyl) ester); 295.1(5.8095,Unknown); 296.1(13.9933,??? Mannitol (6TMS)); 296.3(24.5881,?? EITTMS_N12C_NTAR_3390.2_1135EC27_S); 298.09(8.466,Unknown); 298.1(8.489,Unknown); 299.2(15.0495,?? Pentadecanoic acid (1TMS)); 299.24(15.051,n-Pentadecanoic acid, trimethylsilyl ester); 299.24(15.124,n-Pentadecanoic acid, trimethylsilyl ester); 299.24(15.354,n-Pentadecanoic acid, trimethylsilyl ester); 299.25(14.857,Pentadecanoic acid (1TMS)); 299.27(15.461,Hexadecan-1-ol, n- (1TMS)); 299.3(15.4616,??? Phosphoric acid (3TMS)); 301.13(11.581,1,2,3,4-Tetramethoxybenzene); 303.14(13.161,Suberic acid (tms) (Octanedioic acid)); 305.1(16.4652,??? myo-Inositol (6TMS)); 305.1(16.5931,myo-Inositol (6TMS)); 305.14(15.672,Myo-Inositol, 1,2,3,4,5,6-hexakis-O-(trimethylsilyl)-); 305.14(16.593,INOSITOL,O,O,O,O,O,O-TMS); 307.1(15.258,Trimethylsilyl ether of mannitol); 307.15(13.304,Xylitol, 1,2,3,4,5-pentakis-O-(trimethylsilyl)-); 307.16(13.238,Xylitol, 1,2,3,4,5-pentakis-O-(trimethylsilyl)-); 307.16(14.824,D-Fructose, 1,3,4,5,6-pentakis-O-(trimethylsilyl)-, O-methyloxime); 309.11(14.329,Unknown); 309.17(24.22,à -Tocopherolhydroquinone, tris(trimethylsilyl) ether); 311.2(15.9872,? 9-(Z)-Hexadecenoic acid (1TMS)); 311.24(15.601,Unknown); 311.24(15.952,Palmitelaidic acid, trimethylsilyl ester); 311.24(16.006,Palmitelaidic acid, trimethylsilyl ester); 311.25(15.511,Palmitelaidic acid, trimethylsilyl ester); 311.25(15.555,Palmitelaidic acid, trimethylsilyl ester); 311.29(21.288,Stearic acid, 2-(1-octadecenyloxy)ethyl ester, (E)-); 311.3(21.2855,??? 9-(Z)-Hexadecenoic acid (1TMS)); 313.26(15.712,Unknown); 313.26(15.862,Unknown); 313.3(16.1515,? Hexadecanoic acid (1TMS)); 317.16(14.059,Azelaic acid, bis(trimethylsilyl) ester (Nonanedioic acid)); 318.15(16.092,INOSITOL,O,O,O,O,O,O-TMS); 318.9(15.2215,? Mannitol (6TMS)); 319.15(17.288,Skel_Cell_C128_RT14.776 / Charles); 319.16(13.425,Arabinitol, pentakis-O-(trimethylsilyl)-); 319.16(13.892,d-Glucitol, 1,2,3,4,5,6-hexakis-O-(trimethylsilyl)-); 319.16(14.92,Unknown); 319.16(14.97,EITTMS_N12C_SD2_1889.9_1135EC00_Glucose methoxyamine (5TMS)); 319.16(16.85,Skel_Cell_C128_RT14.776 / Charles); 319.16(17.595,Sedoheptulose, o-methyloxime, hexakis-O-(trimethylsilyl)-); 319.2(13.2568,Pentitol (5TMS)); 319.2(13.8814,?? EITTMS_N12C_ATHR_2105.0_1135EC25_); 319.2(14.9053,Allose methoxyamine (5TMS)); 319.2(14.9541,Galactose methoxyamine (5TMS)); 319.2(15.0846,? Sorbitol (6TMS); Glucitol (6TMS)); 319.2(15.3437,Mannitol (6TMS)); 319.2(15.8941,? Galactonic acid (6TMS)); 319.2(16.8335,?? Sorbitol (6TMS); Glucitol (6TMS)); 319.2(16.9704,? Mannitol (6TMS)); 319.2(17.0189,? EITTMS_N12C_ATHR_2105.0_1135EC25_); 319.33(19.435,C18-C22 long chain w/ 1N and 1 unsta.); 319(17.2757,?? Mannitol (6TMS)); 319(17.3001,??? Mannitol (6TMS)); 320(15.2439,??? Glucose methoxyamine (5TMS)); 325.25(16.784,Heptadecenoic acid (1TMS)); 325.26(16.727,Unknown); 327.1(12.6597,??? Trishydroxybenzene (3TMS)); 327.1(27.2693,Unknown); 327.27(16.46,Heptadecanoic acid (1TMS)); 327.27(16.536,Heptadecanoic acid, trimethylsilyl ester); 327.27(16.647,1,3-Dioxane, 5-(hexadecyloxy)-2-pentadecyl-, trans-); 327.27(16.927,Heptadecanoic acid, trimethylsilyl ester); 327.31(17.027,Unknown); 331.18(14.904,Sebacic acid (2TMS) (1,10-decanedioic acid)); 333.1(16.0374,Gluconic acid (6TMS)); 339.27(17.468,11-cis-Octadecenoic acid, trimethylsilyl ester); 339.27(17.522,11-trans-Octadecenoic acid, trimethylsilyl ester); 341.27(17.665,Octadecanoic acid, trimethylsilyl ester); 342.16(12.643,1,3,5-Tris(trimethylsiloxy)benzene); 345.2(15.702,1,11-Undecanedioic acid, 2 TMS); 350.1(10.8024,??? Maleic acid (2TMS)); 350.15(10.783,CharlesMetabo : Skel_Cell_C033); 352.16(21.458,Unknown); 354.3(17.765,Unknown); 355.1(25.8468,Unknown); 355.3(17.946,Unknown); 355.31(18.123,Unknown); 355.31(18.183,Unknown); 355.31(18.38,Nonadecanoic acid, trimethylsilyl ester); 355.34(18.46,Unknown); 359.21(16.493,Unknown); 359.24(18.994,Octadecanoic acid, 12-(trimethylsiloxy)-, trimethylsilyl ester); 361.17(20.47,à -D-Glucopyranoside, 1,3,4,6-tetrakis-O-(trimethylsilyl)-á-D-fructofuranosyl 2,3,4,6-tetrakis-); 361.17(21.125,TREHALOSE TMS); 361.19(22.614,Unknown); 361.2(20.455,Sucrose (8TMS); alpha-D-Glc-(1,2)-beta-D-Fru); 361.2(21.1367,? Sucrose (8TMS)); 363.2(20.5118,??? EITTMS_N12C_STUT_2832.4_1135EC30_); 367.31(18.931,Unknown); 368.35(23.382,Cholesterol trimethylsilyl ether); 369.1(8.0117,??? EITTMS_N12C_ATHR_1234.3_1135EC44_); 369.17(11.281,Unknown); 369.2(11.2931,Unknown); 369.32(18.811,Eicosanoic acid, trimethylsilyl ester); 369.32(19.064,Eicosanoic acid, trimethylsilyl ester); 371.3(20.0066,??? 1-Monohexadecanoylglycerol (2TMS)); 371.3(20.023,Unknown); 373.23(17.218,Decanedioic acid, bis(tert-butyldimethylsilyl) ester); 375.17(15.405,Unknown); 375.17(15.642,Unknown); 375.2(15.3675,Unknown); 375.2(15.4078,Unknown); 375.2(15.4175,Unknown); 379.25(16.199,Unknown); 383.33(19.485,Unknown); 383.34(19.549,Unknown); 383.34(19.722,1,6-Dihydroxy-2-methylanthraquinone, O,O;-vis(trimethylsilyl)- ); 384.16(14.396,Homogentisic acid (tms) / Benzeneacetic acid, 2,5-bis[(trimethylsilyl)oxy]-, trimethylsilyl ester); 384.2(14.3913,Unknown); 384.2(14.3953,Unknown); 386.3(24.607,Fucosterol (1TMS)); 397.36(20.126,Unknown); 397.38(23.508,Unknown); 399.33(21.225,Unknown); 406.29(16.536,Unknown); 406.3(16.5,Unknown); 411.37(20.754,Lanost-8-en-3-one); 411.37(20.814,C23 TMS); 411.37(20.974, Tricosanoic acid, n- (1TMS)); 425.38(21.572,Tetracosanoic acid, trimethylsilyl ester); 431.2(13.7596,??? EITTMS_N12C_ATHR_1795.4_1135EC44_); 439.4(21.999,Pentacosanoic acid (1TMS)); 439.4(22.146,Pentacosanoic acid (1TMS)); 453.41(22.707,Hexacosanoic acid (1TMS)); 453.42(22.504,Hexacosanoic acid (1TMS)); 455.28(19.792,Unknown); 467.43(23.108,Heptacosanoic acid, n- (1TMS)); 467.43(23.251,Heptacosanoic acid, n- (1TMS)); 469.41(24.056,Lanost-8-en-7-one, 3-(acetyloxy)-, (3á,13à ,14á,17à )-); 473.4(24.738,Stigmastan-3-ol, (3-beta)- (1TMS)); 474.39(21.936,delta-Tocopherol (1TMS)); 474.4(21.9424,Unknown); 481.45(23.856,Octacosanoic acid (1TMS)); 488.41(22.43,Tocopherol-ç-tms-derivative ); 509.45(25.315,Unknown); 53(24.5681,Unknown); 55.1(18.1735,Unknown); 55.1(19.1274,??? n-Pentadecane); 55.1(20.3938,Unknown); 55.1(21.0586,Unknown); 55.1(22.057,Unknown); 55.1(23.9836,Unknown); 55.1(26.9957,Unknown); 56.07(20.413,Unknown); 56.1(19.1034,Unknown); 56.1(19.4725,Unknown); 56.1(20.0967,Unknown); 56.1(20.1668,Unknown); 56.1(22.3078,Unknown); 57.07(14.106,non-RImix alcane); 57.1(11.217,n-Pentadecane); 57.1(14.1178,??? n-Pentadecane); 57.1(14.9761,n-Nonadecane); 57.1(17.3578,n-Docosane); 57.1(18.4157,Unknown); 57.1(19.4458,Unknown); 57.1(19.6332,Unknown); 57.1(19.9169,Unknown); 57.1(19.9392,Unknown); 57.1(20.1124,??? Tyrosine (2TMS)); 57.1(20.4128,Unknown); 57.1(21.3589,n-Octacosane); 57.1(21.4627,Unknown); 57.1(23.6503,? n-Octacosane); 57.1(24.7223,Unknown); 57.1(26.9423,Unknown); 57.1(28.3542,Unknown); 57.1(5.1575,??? n-Dodecane); 57.1(7.6107,??? EITTMS_N12C_ATHR_2052.2_1135EC06_); 58(18.5082,Unknown); 58(18.698,Unknown); 58(20.2808,Unknown); 58(21.0857,??? Sucrose (6TMS)); 58(22.8242,Unknown); 58(23.8335,Unknown); 58(23.8435,Unknown); 58(26.3721,Unknown); 58(5.0629,??? 4-Hydroxybutanoic acid (2TMS)); 58(5.1888,??? EITTMS_N12C_ATHR_1234.3_1135EC44_); 59(15.2068,Unknown); 59(26.6815,Unknown); 60(16.5323,Unknown); 60(5.4968,Unknown); 600.29(24.133,2,4,6,-Tris(4-n-dodecylphenoxy)-1,3,5-triazine); 61(25.0754,Unknown); 61(26.3048,Unknown); 62(26.4916,Unknown); 62(27.5131,Unknown); 63(27.0658,Unknown); 67.1(17.5146,Unknown); 67.1(17.7936,Unknown); 67.1(18.1468,Unknown); 67.1(23.974,Unknown); 67.1(25.8802,Unknown); 68.1(19.6828,Unknown); 68.1(25.7532,Unknown); 68.1(7.4909,Unknown); 682.28(18.099,Unknown); 682.3(18.096,Unknown); 682.3(18.1097,Unknown); 70.1(24.6051,??? EITTMS_N12C_NTAR_3390.2_1135EC27_S); 70.1(26.9252,Unknown); 70(22.6512,Unknown); 71.08(15.812,1,3-Dioxolane, 2,2-dimethyl-4-[(tetradecyloxy)methyl]-); 71.09(14.186,CharlesMetabo : Skel_Cell_C176); 71.1(19.07,Unknown); 71.1(19.7056,Unknown); 71.1(26.9556,??? n-Octacosane); 71.1(5.1581,Unknown); 72.05(7.591,Unknown); 72.1(6.3417,Unknown); 72(15.2718,??? D(-)-Quinic acid (5TMS)); 74.04(16.8,Octadecanoic acid, methyl ester); 74(5.6586,Unknown); 74(7.4705,??? EITTMS_N12C_ATHR_1234.3_1135EC44_); 74(8.2674,Unknown); 75(11.5994,?? N-Acetylglutamic acid (2TMS)); 75(14.2038,? Tetradecanoic acid (1TMS)); 75(15.2969,??? Hexitol (6TMS); B6); 75(15.3214,Mannitol (6TMS)); 75(15.3354,??? Galactitol (6TMS)); 75(17.5166,??? Octadecenoic acid (1TMS)); 75(17.6083,??? Hexitol (6TMS); B6); 75(17.7495,??? Glucopyranose (5TMS)); 75(18.118,Unknown); 75(18.396,Unknown); 75(18.6123,Unknown); 75(19.0175,Unknown); 75(19.3473,Unknown); 75(19.4391,Unknown); 75(20.7279,Unknown); 75(20.8984,? EITTMS_N12C_STUT_2832.4_1135EC30_); 75(21.4477,Unknown); 75(21.7832,Unknown); 75(21.8059,Unknown); 75(22.076,Unknown); 75(23.0925,Unknown); 75(23.3181,Unknown); 75(23.4208,Unknown); 75(23.5241,Unknown); 75(24.0221,Unknown); 75(24.0404,Unknown); 75(25.1889,Unknown); 75(26.5613,??? Glucopyranose (5TMS)); 75(27.2529,Unknown); 75(28.8088,Unknown); 75(29.5234,Unknown); 75(5.0643,??? 4-Hydroxybutanoic acid (2TMS)); 75(5.2088,Unknown); 75(7.2865,??? EITTMS_N12C_ATHR_1442.5_1135EC44_); 75(7.352,??? Suberic acid (2TMS)); 75(9.1351,Succinic acid (2TMS)); 75(9.4695,? 2-Methyl-2-butenedioic acid (2TMS)); 75(9.6691,? Nonanoic acid (1TMS)); 75(9.8186,Threonic acid-1,4-lactone (2TMS), trans-); 76(25.4773,Unknown); 76(28.4315,Unknown); 81.1(18.3742,Unknown); 81.1(21.7622,Unknown); 81.1(23.9569,Unknown); 81.1(24.1906,Unknown); 81(5.1414,Unknown); 82.08(14.733,Unknown); 82.1(14.4375,??? Glycerol (3TMS)); 82.1(17.9964,Unknown); 82.1(19.6932,Unknown); 82.1(26.972,Unknown); 83.1(18.7391,??? Asparagine (3TMS)); 83.1(21.4289,Unknown); 83.1(27.7236,Unknown); 84.1(27.0053,Unknown); 84(11.58,??? N-Acetylglutamic acid (2TMS)); 85.08(19.104,Unknown); 85.1(20.1151,Unknown); 85.1(22.688,Unknown); 85.1(5.1287,Unknown); 85.1(5.146,??? n-Pentadecane); 87.04(15.181,Hexadecanoic acid, methyl ester (palmitic acid)); 87(16.7937,??? n-Nonadecanoic acid methyl ester); 89.04(7.541,Unknown); 89.5(5.6667,Unknown); 91.03(10.917,n-Undecyl chloride); 91.06(19.154,Unknown); 91.1(17.8405,Unknown); 91.1(19.7734,Unknown); 91.1(25.299,Unknown); 91.1(27.817,Unknown); 95.1(17.473,??? 9-(Z)-Octadecenoic acid (1TMS)); 95.1(18.671,Unknown); 95.1(20.1234,Unknown); 95.1(21.3092,Unknown); 95.1(23.69,Unknown); 95(20.2417,Unknown); 96.1(20.3037,Unknown); 97.1(13.211,Unknown); 97.1(13.2184,??? Squalene); 97.1(15.95,Unknown); 97.1(16.0625,Unknown); 97.1(16.073,Unknown); 97.1(18.4251,Unknown); 97.1(19.1568,Unknown); 97.1(19.3559,Unknown); 97.1(19.8004,Unknown); 97.1(20.9421,Unknown); 97.1(22.9251,Unknown); 97.1(23.5431,Unknown); 97(29.3302,Unknown); 99.1(18.8012,Unknown); 99.1(23.0554,Unknown); 99.1(25.0254,Unknown); 99.1(26.9823,Unknown); 99.1(27.0187,??? 1-Octadecanol (1TMS)); Conc; Concentration; Date/Time; DATE/TIME; Kiel-Buelk_outer-Kiel-Fjord; Label; MULT; Multiple investigations; Sample code/label; Species
Tipo

Dataset