ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004714
RECORD_TITLE: ALLYLBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: ALLYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀
CH$EXACT_MASS: 118.07825
CH$SMILES: C=CCc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-5,7-8H,1,6H2
CH$LINK: CAS 300-57-2
CH$LINK: COMPTOX DTXSID00861855
CH$LINK: INCHIKEY HJWLCRVIBGQPNF-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:9309

AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-014i-3900000000-77b3ba66c4073c4892cb
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  50 3.43 34
  51 8.45 85
  52 2.14 21
  57 1.4 14
  58 6.79 68
  62 1.98 20
  63 5.6 56
  64 1.3 13
  65 9.85 99
  74 1.23 12
  75 1.16 12
  76 1.1 11
  77 5.17 52
  78 6.22 62
  89 4.65 47
  90 2.31 23
  91 33.91 339
  92 3.16 32
  102 1.57 16
  103 7.93 79
  115 27.1 271
  116 7.42 74
  117 99.99 999
  118 82.97 830
  119 8.02 80
//