MassBank Record: KZ000055



 L-Tryptophan; GC-EI-TOF; MS; 3 TMS; BP:202 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000055
RECORD_TITLE: L-Tryptophan; GC-EI-TOF; MS; 3 TMS; BP:202
DATE: 2016.01.19 (2009.03.11, 2011.05.06)
AUTHORS: Ara TKazusa DNA Research Institute, Morishita YKazusa DNA Research Institute, Shibata DKazusa DNA Research Institute, Kazusa DNA Research Institute
LICENSE: CC BY-SA
COMMENT: MassBase peak ID: MDGC1_01583_P000150

CH$NAME: L-Tryptophan CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C11H12N2O2 CH$EXACT_MASS: 204.08988 CH$SMILES: C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)N CH$IUPAC: InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1 CH$LINK: CAS 73-22-3 CH$LINK: KEGG C00078 CH$LINK: INCHIKEY QIVBCDIJIAJPQS-VIFPVBQESA-N CH$LINK: COMPTOX DTXSID5021419
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$CHROMATOGRAPHY: COLUMN_NAME DB-17MS AC$CHROMATOGRAPHY: RETENTION_INDEX 2406.8 AC$CHROMATOGRAPHY: RETENTION_TIME 1073.36 sec
MS$FOCUSED_ION: BASE_PEAK 202 MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-0udi-0190000000-feaec8547634dddcad8c PK$NUM_PEAK: 83 PK$PEAK: m/z int. rel.int. 86 3 3 87 1 1 100 40 40 101 19 19 102 2 2 105 2 2 115 4 4 117 1 1 118 1 1 119 2 2 120 1 1 130 19 19 131 9 9 132 15 15 133 9 9 134 4 4 135 1 1 142 1 1 143 1 1 144 4 4 145 9 9 146 4 4 147 17 17 148 6 6 149 3 3 156 3 3 157 1 1 158 2 2 159 3 3 160 4 4 161 2 2 163 1 1 169 1 1 170 3 3 171 2 2 172 3 3 173 1 1 184 2 2 185 2 2 186 6 6 187 3 3 188 2 2 190 5 5 191 1 1 198 1 1 199 4 4 200 25 25 201 11 11 202 999 999 203 265 265 204 84 84 205 14 14 206 2 2 214 2 2 215 1 1 216 1 1 218 43 43 219 12 12 220 6 6 221 1 1 230 7 7 231 2 2 232 1 1 246 1 1 248 1 1 249 1 1 288 1 1 290 1 1 291 63 63 292 30 30 293 18 18 294 4 4 295 1 1 302 1 1 303 7 7 304 2 2 305 1 1 377 2 2 378 2 2 379 1 1 405 3 3 406 1 1 407 1 1 //

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