ACCESSION: MSBNK-Kazusa-KZ000234
RECORD_TITLE: L-(+)-Lysine; GC-EI-TOF; MS; 3 TMS; BP:174
DATE: 2016.01.19 (Created 2009.03.11, modified 2011.05.06)
AUTHORS: Ara T, Morishita Y, Shibata D, Kazusa DNA Research Institute
LICENSE: CC BY-SA
COMMENT: MassBase peak ID: MDGC1_01569_P000156

CH$NAME: L-Lysine
CH$NAME: L-(+)-Lysine
CH$COMPOUND_CLASS: Natural Product
CH$FORMULA: C₆H₁₄N₂O₂
CH$EXACT_MASS: 146.10553
CH$SMILES: NCCCC[C@H](N)C(O)=O
CH$IUPAC: InChI=1S/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1
CH$LINK: CAS 56-87-1
CH$LINK: KEGG C00047
CH$LINK: INCHIKEY KDXKERNSBIXSRK-YFKPBYRVSA-N
CH$LINK: COMPTOX DTXSID6023232

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 1901.3
AC$CHROMATOGRAPHY: RETENTION_TIME 884.312 sec

MS$FOCUSED_ION: BASE_PEAK 174
MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)

PK$SPLASH: splash10-00di-3910000000-98c565675de67aa87900
PK$NUM_PEAK: 128
PK$PEAK: m/z int. rel.int.
  82 73 73
  83 16 16
  84 282 282
  85 33 33
  86 235 235
  87 30 30
  88 52 52
  89 7 7
  90 4 4
  91 2 2
  92 1 1
  93 1 1
  94 14 14
  95 3 3
  96 2 2
  97 6 6
  98 12 12
  99 11 11
  100 125 125
  101 23 23
  102 50 50
  103 20 20
  104 4 4
  105 1 1
  107 1 1
  109 1 1
  110 6 6
  111 3 3
  112 24 24
  113 10 10
  114 39 39
  115 19 19
  116 20 20
  117 21 21
  118 5 5
  119 3 3
  124 2 2
  125 1 1
  126 7 7
  127 3 3
  128 60 60
  129 15 15
  130 64 64
  131 30 30
  132 18 18
  133 17 17
  134 3 3
  135 1 1
  138 1 1
  139 1 1
  140 9 9
  141 3 3
  142 23 23
  143 5 5
  144 11 11
  145 3 3
  146 31 31
  147 56 56
  148 16 16
  149 6 6
  150 2 2
  151 1 1
  154 6 6
  155 5 5
  156 135 135
  157 22 22
  158 16 16
  159 3 3
  160 5 5
  161 2 2
  162 3 3
  166 4 4
  167 5 5
  168 33 33
  169 6 6
  170 6 6
  171 2 2
  172 21 21
  173 6 6
  174 999 999
  175 176 176
  176 78 78
  177 9 9
  178 1 1
  182 1 1
  183 3 3
  184 7 7
  185 2 2
  186 12 12
  187 3 3
  188 4 4
  189 1 1
  190 1 1
  198 1 1
  199 2 2
  200 150 150
  201 30 30
  202 11 11
  203 1 1
  204 1 1
  214 2 2
  215 1 1
  216 5 5
  217 1 1
  218 1 1
  227 1 1
  228 1 1
  229 2 2
  230 20 20
  231 6 6
  232 3 3
  242 1 1
  244 1 1
  245 1 1
  246 1 1
  255 1 1
  257 3 3
  258 34 34
  259 8 8
  260 3 3
  289 4 4
  290 1 1
  317 1 1
  347 2 2
  361 1 1
  362 10 10
  363 3 3
  364 1 1
//