MassBank Record: KZ000163



 L-Tyrosine; GC-EI-TOF; MS; 3 TMS; BP:218 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000163
RECORD_TITLE: L-Tyrosine; GC-EI-TOF; MS; 3 TMS; BP:218
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_05071_P000045

CH$NAME: L-Tyrosine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C9H11NO3 CH$EXACT_MASS: 181.07389 CH$SMILES: OC(=O)C(N)Cc(c1)ccc(O)c1 CH$IUPAC: InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1 CH$LINK: CAS 60-18-4 CH$LINK: KEGG C00082 CH$LINK: INCHIKEY OUYCCCASQSFEME-QMMMGPOBSA-N CH$LINK: COMPTOX DTXSID1023730
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 0.0000 AC$CHROMATOGRAPHY: RETENTION_TIME 930.013 sec
MS$FOCUSED_ION: BASE_PEAK 218 MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-014i-0890000000-ca45f993f95c8b0cee44 PK$NUM_PEAK: 133 PK$PEAK: m/z int. rel.int. 82 3 3 83 3 3 84 9 9 85 6 6 86 17 17 87 6 6 88 2 2 89 18 18 90 13 13 91 35 35 92 4 4 93 3 3 95 3 3 96 1 1 97 1 1 98 2 2 99 2 2 100 367 367 101 51 51 102 22 22 103 23 23 104 7 7 105 18 18 106 3 3 107 5 5 108 1 1 109 2 2 110 1 1 113 1 1 114 1 1 115 15 15 116 7 7 117 20 20 118 13 13 119 12 12 120 2 2 121 5 5 122 1 1 123 2 2 128 2 2 129 2 2 130 33 33 131 26 26 132 37 37 133 38 38 134 9 9 135 18 18 136 3 3 137 2 2 142 1 1 143 1 1 144 4 4 145 6 6 146 11 11 147 165 165 148 33 33 149 39 39 150 6 6 151 7 7 152 1 1 157 1 1 158 4 4 159 6 6 160 10 10 161 7 7 162 4 4 163 30 30 164 11 11 165 15 15 166 3 3 167 1 1 172 2 2 173 1 1 174 9 9 175 7 7 176 10 10 177 9 9 178 3 3 179 86 86 180 19 19 181 6 6 182 2 2 188 1 1 189 1 1 190 6 6 191 3 3 192 18 18 193 5 5 194 1 1 195 1 1 202 1 1 203 7 7 204 2 2 205 2 2 206 2 2 207 10 10 208 3 3 209 3 3 216 1 1 217 4 4 218 999 999 219 181 181 220 77 77 221 10 10 222 2 2 223 3 3 224 1 1 234 1 1 248 2 2 249 1 1 250 2 2 264 3 3 265 11 11 266 4 4 267 2 2 278 2 2 279 8 8 280 85 85 281 22 22 282 8 8 283 1 1 291 1 1 292 3 3 293 1 1 353 3 3 354 20 20 355 10 10 356 5 5 357 1 1 381 2 2 382 8 8 383 3 3 384 1 1 //

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