ACCESSION: MSBNK-Osaka_Univ-OUF00118
RECORD_TITLE: L-Arabinose; GC-EI-TOF; MS; n TMS; RT:621.494 sec
DATE: 2016.01.19 (Created 2010.05.20, modified 2013.04.24)
AUTHORS: Tsujimoto Y, Tsugawa H, Bamba T, Fukusaki E, 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$NAME: L-Arabinose
CH$COMPOUND_CLASS: Natural Product
CH$FORMULA: C₅H₁₀O₅
CH$EXACT_MASS: 150.05282
CH$SMILES: C([C@@H]([C@@H]([C@H](C=O)O)O)O)O
CH$IUPAC: InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4-,5+/m0/s1
CH$LINK: CAS 147-81-9
CH$LINK: CHEBI 6182
CH$LINK: CHEMSPIDER 4573877
CH$LINK: PUBCHEM CID:5460291
CH$LINK: INCHIKEY PYMYPHUHKUWMLA-VAYJURFESA-N
CH$LINK: COMPTOX DTXSID9039733

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$CHROMATOGRAPHY: RETENTION_INDEX 1643.528
AC$CHROMATOGRAPHY: RETENTION_TIME 621.494 sec
AC$CHROMATOGRAPHY: TRANSFARLINE_TEMPERATURE 250 C

MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (LECO)

PK$SPLASH: splash10-0uxr-0920000000-a72c4b3c61ef01d178bf
PK$NUM_PEAK: 169
PK$PEAK: m/z int. rel.int.
  85 11 11
  86 12 12
  87 14 14
  88 11 11
  89 136 136
  90 13 13
  91 7 7
  92 1 1
  94 3 3
  95 1 1
  96 1 1
  97 1 1
  98 5 5
  99 11 11
  100 46 46
  101 48 48
  102 24 24
  103 999 999
  104 98 98
  105 70 70
  106 5 5
  107 2 2
  110 1 1
  111 4 4
  112 5 5
  113 12 12
  114 20 20
  115 18 18
  116 17 17
  117 118 118
  118 13 13
  119 18 18
  120 2 2
  121 1 1
  126 6 6
  127 7 7
  128 8 8
  129 95 95
  130 23 23
  131 50 50
  132 9 9
  133 127 127
  134 18 18
  135 11 11
  136 1 1
  137 1 1
  139 1 1
  140 3 3
  141 3 3
  142 9 9
  143 26 26
  144 5 5
  145 15 15
  146 4 4
  147 372 372
  148 60 60
  149 42 42
  150 5 5
  151 3 3
  152 1 1
  154 1 1
  155 1 1
  156 3 3
  157 8 8
  158 11 11
  159 6 6
  160 76 76
  161 21 21
  162 5 5
  163 18 18
  164 3 3
  165 2 2
  167 1 1
  168 8 8
  169 3 3
  170 2 2
  172 6 6
  173 9 9
  174 16 16
  175 13 13
  176 3 3
  177 7 7
  178 1 1
  179 1 1
  184 1 1
  185 1 1
  186 3 3
  187 1 1
  188 1 1
  189 90 90
  190 20 20
  191 33 33
  192 6 6
  193 3 3
  198 7 7
  199 1 1
  200 4 4
  201 7 7
  202 2 2
  203 6 6
  204 45 45
  205 45 45
  206 11 11
  207 8 8
  208 1 1
  214 2 2
  215 2 2
  216 9 9
  217 406 406
  218 87 87
  219 40 40
  220 6 6
  221 11 11
  222 2 2
  223 1 1
  228 2 2
  229 1 1
  230 3 3
  231 9 9
  232 5 5
  233 31 31
  234 13 13
  235 4 4
  236 1 1
  240 1 1
  241 1 1
  242 4 4
  243 1 1
  244 2 2
  246 2 2
  248 3 3
  249 1 1
  256 6 6
  257 4 4
  258 2 2
  261 1 1
  262 11 11
  263 3 3
  264 2 2
  272 2 2
  274 3 3
  275 1 1
  276 1 1
  277 30 30
  278 12 12
  279 6 6
  280 2 2
  288 3 3
  289 1 1
  290 1 1
  291 6 6
  292 1 1
  293 1 1
  305 2 2
  306 4 4
  307 139 139
  308 44 44
  309 22 22
  310 5 5
  311 1 1
  316 1 1
  319 1 1
  330 4 4
  331 3 3
  332 1 1
  362 2 2
  363 1 1
  364 1 1
  467 1 1
//