ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001690
RECORD_TITLE: ISOPROPENYLBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: ISOPROPENYLBENZENE
CH$NAME: ALPHA-METHYLSTYRENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀
CH$EXACT_MASS: 118.07825
CH$SMILES: CC(=C)c(c1)cccc1
CH$IUPAC: InChI=1S/C9H10/c1-8(2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
CH$LINK: INCHIKEY XYLMUPLGERFSHI-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9025661

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-014i-6900000000-13e1647c84d252f25812
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  27 3.55 36
  28 2.95 30
  38 1.81 18
  39 12.99 130
  40 1.74 17
  41 2.11 21
  50 7.7 77
  51 19.71 197
  52 4.38 44
  53 1.59 16
  57 2.49 25
  57.5 5.97 60
  58 9.74 97
  62 2.49 25
  63 7.18 72
  65 6.19 62
  74 3.17 32
  75 2.87 29
  76 3.47 35
  77 26.13 261
  78 37.24 372
  79 2.95 30
  89 3.85 39
  90 1.66 17
  91 19.86 199
  92 1.96 20
  102 5.21 52
  103 55.89 559
  104 4.68 47
  115 26.59 266
  116 6.04 60
  117 79.46 795
  118 99.99 999
  119 9.74 97
//