ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010019
RECORD_TITLE: 2-PHENYL-PROPANAL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 2-PHENYL-PROPANAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O
CH$EXACT_MASS: 134.07316
CH$SMILES: O=CC(C)c(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O/c1-8(7-10)9-5-3-2-4-6-9/h2-8H,1H3
CH$LINK: COMPTOX DTXSID0052629
CH$LINK: INCHIKEY IQVAERDLDAZARL-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7146
AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-4900000000-81527d703e7b4bf031c2
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  27 2.7 27
  28 1.8 18
  39 5.2 52
  50 0.45 5
  51 11.5 115
  52 2.5 25
  63 4.7 47
  65 0.35 4
  74 2.1 21
  75 1.6 16
  77 31.3 313
  78 0.83 8
  79 29.6 296
  80 1.8 18
  89 2.4 24
  91 1.49 15
  102 2.3 23
  103 21.1 211
  104 6.8 68
  105 99.99 999
  107 22.5 225
  134 26.1 261
  135 2.5 25
//
