ACCESSION: MSBNK-Kazusa-KZ000222
RECORD_TITLE: L-(+)-Arginine; GC-EI-TOF; MS; 3 TMS; BP:157
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_01548_P000267

CH$NAME: L-Arginine
CH$NAME: L-(+)-Arginine
CH$COMPOUND_CLASS: Natural Product
CH$FORMULA: C₆H₁₄N₄O₂
CH$EXACT_MASS: 174.11168
CH$SMILES: NC(=N)NCCC[C@H](N)C(O)=O
CH$IUPAC: InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1
CH$LINK: CAS 74-79-3
CH$LINK: KEGG C00062
CH$LINK: INCHIKEY ODKSFYDXXFIFQN-BYPYZUCNSA-N
CH$LINK: COMPTOX DTXSID6041056

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 1884.4
AC$CHROMATOGRAPHY: RETENTION_TIME 873.263 sec

MS$FOCUSED_ION: BASE_PEAK 157
MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)

PK$SPLASH: splash10-0a4i-1910000000-0191c1a63652c493660b
PK$NUM_PEAK: 167
PK$PEAK: m/z int. rel.int.
  82 14 14
  83 43 43
  84 162 162
  85 83 83
  86 53 53
  87 22 22
  88 10 10
  89 6 6
  90 38 38
  91 4 4
  92 5 5
  93 10 10
  94 3 3
  95 18 18
  96 13 13
  97 15 15
  98 55 55
  99 187 187
  100 249 249
  101 48 48
  102 32 32
  103 45 45
  104 6 6
  105 7 7
  106 1 1
  107 1 1
  108 1 1
  109 2 2
  110 10 10
  111 11 11
  112 27 27
  113 34 34
  114 58 58
  115 106 106
  116 26 26
  117 35 35
  118 8 8
  119 10 10
  120 2 2
  121 5 5
  122 5 5
  123 2 2
  124 10 10
  125 20 20
  126 22 22
  127 76 76
  128 67 67
  129 35 35
  130 45 45
  131 50 50
  132 44 44
  133 63 63
  134 11 11
  135 5 5
  136 1 1
  137 1 1
  138 2 2
  139 27 27
  140 86 86
  141 217 217
  142 437 437
  143 75 75
  144 33 33
  145 6 6
  146 7 7
  147 179 179
  148 37 37
  149 19 19
  150 4 4
  151 4 4
  152 10 10
  153 8 8
  154 29 29
  155 55 55
  156 57 57
  157 999 999
  158 157 157
  159 63 63
  160 10 10
  161 2 2
  162 1 1
  163 2 2
  165 1 1
  166 5 5
  167 19 19
  168 28 28
  169 13 13
  170 21 21
  171 97 97
  172 76 76
  173 28 28
  174 14 14
  175 4 4
  176 1 1
  182 4 4
  183 6 6
  184 17 17
  185 8 8
  186 9 9
  187 33 33
  188 16 16
  189 7 7
  190 4 4
  191 2 2
  194 1 1
  195 1 1
  196 3 3
  197 2 2
  198 7 7
  199 4 4
  200 3 3
  201 1 1
  202 8 8
  203 3 3
  204 7 7
  205 1 1
  206 1 1
  211 1 1
  212 2 2
  213 6 6
  214 5 5
  215 21 21
  216 33 33
  217 13 13
  218 40 40
  219 10 10
  220 4 4
  221 1 1
  224 2 2
  225 1 1
  226 1 1
  227 1 1
  228 2 2
  229 2 2
  230 4 4
  231 10 10
  232 4 4
  233 1 1
  240 17 17
  241 7 7
  242 5 5
  243 5 5
  244 32 32
  245 12 12
  246 5 5
  247 1 1
  254 3 3
  255 5 5
  256 323 323
  257 77 77
  258 32 32
  259 12 12
  260 3 3
  261 1 1
  268 7 7
  269 3 3
  270 1 1
  283 3 3
  284 3 3
  330 4 4
  331 2 2
  358 6 6
  359 2 2
  372 1 1
  373 11 11
  374 4 4
  375 1 1
//