MassBank Record: OUF00293



 L-(+)-Tartaric acid; GC-EI-TOF; MS; n TMS; RT:611.094 sec 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: OUF00293
RECORD_TITLE: L-(+)-Tartaric acid; GC-EI-TOF; MS; n TMS; RT:611.094 sec
DATE: 2016.01.19 (2010.05.20, 2013.04.24)
AUTHORS: Tsujimoto Yengineering department, Osaka Univ., Tsugawa Hengineering department, Osaka Univ., Bamba Tengineering department, Osaka Univ., Fukusaki Eengineering department, Osaka Univ., engineering department, Osaka Univ.
LICENSE: CC BY-SA
COMMENT: The chemical compound was chemically modified with N-methyl-N-trimethylsilyl-trifluoroacetamide (MSTFA) before GC-MS analysis. When it has two or more functional groups, this modification gave a mixture of the TMS derivatives having different number of TMS groups at different functional groups.

CH$NAME: L-(+)-Tartarate CH$NAME: L-(+)-Tartaric acid CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C4H6O6 CH$EXACT_MASS: 150.01644 CH$SMILES: OC(=O)C([H])(O)C([H])(O)C(O)=O CH$IUPAC: InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m1/s1 CH$LINK: CAS 87-69-4 CH$LINK: CHEBI 15671 30924 CH$LINK: CHEMSPIDER 392277 CH$LINK: KEGG D00103 D00679 D00837 D01561 D01850 D01852 D02238 D02836 D02981 D03825 CH$LINK: PUBCHEM 444305 CH$LINK: INCHIKEY FEWJPZIEWOKRBE-JCYAYHJZSA-N
AC$INSTRUMENT: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies AC$INSTRUMENT_TYPE: GC-EI-TOF AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: HELIUM_FLOW 1 ml/min AC$MASS_SPECTROMETRY: ION_SOURCE_TEMPERATURE 200 C AC$MASS_SPECTROMETRY: SCAN_RANGE_M/Z 85-500 AC$CHROMATOGRAPHY: COLUMN_NAME CP-SIL 8 CB LOW BLEED/MS AC$CHROMATOGRAPHY: INJECTION_TEMPERATURE 230 C AC$CHROMATOGRAPHY: OVEN_TEMPERATURE 80 C (Duration 2 min)-330 C (rate: 15 C/min; Duration 6 min) AC$CHROMATOGRAPHY: RETENTION_INDEX 1620.895 AC$CHROMATOGRAPHY: RETENTION_TIME 611.094 sec AC$CHROMATOGRAPHY: TRANSFARLINE_TEMPERATURE 250 C
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (LECO)
PK$SPLASH: splash10-0002-0930000000-19235937e21066a9c484 PK$NUM_PEAK: 144 PK$PEAK: m/z int. rel.int. 85 12 12 86 4 4 87 16 16 88 5 5 89 8 8 90 1 1 91 1 1 92 2 2 93 6 6 95 3 3 96 2 2 97 1 1 98 1 1 99 20 20 100 4 4 101 25 25 102 142 142 103 73 73 104 13 13 105 13 13 106 1 1 107 1 1 113 5 5 114 1 1 115 27 27 116 11 11 117 47 47 118 7 7 119 20 20 120 3 3 121 2 2 125 1 1 127 4 4 129 6 6 130 88 88 131 99 99 132 20 20 133 170 170 134 25 25 135 16 16 136 2 2 141 1 1 142 4 4 143 136 136 144 18 18 145 12 12 146 3 3 147 999 999 148 162 162 149 109 109 150 13 13 151 5 5 157 7 7 158 1 1 159 5 5 160 1 1 161 6 6 162 1 1 163 17 17 164 3 3 165 2 2 171 52 52 172 6 6 173 10 10 174 1 1 175 67 67 176 11 11 177 14 14 178 2 2 179 1 1 185 2 2 187 1 1 188 1 1 189 316 316 190 65 65 191 71 71 192 16 16 193 9 9 194 2 2 201 2 2 203 1 1 204 18 18 205 11 11 206 4 4 207 20 20 208 5 5 209 3 3 215 3 3 216 1 1 217 55 55 218 12 12 219 219 219 220 43 43 221 104 104 222 23 23 223 12 12 224 2 2 231 11 11 232 4 4 233 2 2 245 2 2 259 3 3 261 1 1 263 21 21 264 6 6 265 3 3 277 19 19 278 7 7 279 9 9 280 2 2 281 1 1 291 3 3 292 271 271 293 83 83 294 41 41 295 9 9 296 2 2 304 1 1 305 61 61 306 23 23 307 12 12 308 3 3 321 9 9 322 3 3 323 1 1 333 28 28 334 10 10 335 6 6 336 1 1 351 6 6 352 3 3 353 2 2 354 1 1 367 5 5 368 3 3 369 2 2 395 1 1 396 1 1 422 2 2 423 43 43 424 22 22 425 11 11 426 3 3 438 2 2 //