ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008706
RECORD_TITLE: 3-PHENYLPROPANAL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 3-PHENYLPROPANAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O
CH$EXACT_MASS: 134.07316
CH$SMILES: O=CCCc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H2
CH$LINK: INCHIKEY YGCZTXZTJXYWCO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0047610
AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-002f-9200000000-79841a7270e9c9570f25
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  15 1.2 12
  26 1.9 19
  27 12.27 123
  29 11.71 117
  38 2.77 28
  39 19.11 191
  41 2.35 24
  42 1.14 11
  50 8.72 87
  51 26.54 265
  52 5.23 52
  53 2.85 29
  55 3.29 33
  56 2.56 26
  57 1.01 10
  62 2.93 29
  63 8.64 86
  64 1.8 18
  65 19.13 191
  66 1.34 13
  74 2.89 29
  75 2.47 25
  76 2.24 22
  77 32.15 322
  78 53.27 533
  79 20.82 208
  80 1.31 13
  89 4.23 42
  90 1.86 19
  91 99.99 999
  92 73.4 734
  93 4 40
  102 2.12 21
  103 12.5 125
  104 4.25 43
  105 32.7 327
  106 3.67 37
  107 1.18 12
  115 4.46 45
  116 3.62 36
  117 1.43 14
  133 6.2 62
  134 54.93 549
  135 4.26 43
//
