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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009450

BETA-METHYLSTYRENE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009450
RECORD_TITLE: BETA-METHYLSTYRENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: EGUCHI S, FAC. OF SCIENCE, HIROSHIMA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: BETA-METHYLSTYRENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10
CH$EXACT_MASS: 118.07825
CH$SMILES: CC=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-8H,1H3/b6-2+
CH$LINK: INCHIKEY QROGIFZRVHSFLM-QHHAFSJGSA-N

AC$INSTRUMENT: HITACHI RMS-4
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 80 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-014i-4900000000-a3f8f45d0479c0c38e7d
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  40 1 10
  41 2 20
  43 1 10
  50 5 50
  51 7 70
  52 2 20
  53 1.5 15
  55 1 10
  62 2.5 25
  63 8.5 85
  64 1 10
  65 6 60
  66 1 10
  70 1 10
  74 2.5 25
  75 1.5 15
  76 1.5 15
  77 8.5 85
  78 9.5 95
  79 1.5 15
  87 1 10
  89 4.5 45
  90 1.5 15
  91 27 270
  92 1 10
  102 1 10
  103 8 80
  104 1 10
  114 1 10
  115 31.5 315
  116 5.5 55
  117 99.99 999
  118 67.5 675
  119 5.5 55
//

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