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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001672

ETHYLBENZENE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001672
RECORD_TITLE: ETHYLBENZENE; 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$NAME: ETHYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10
CH$EXACT_MASS: 106.07825
CH$SMILES: CCc(c1)cccc1
CH$IUPAC: InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3
CH$LINK: INCHIKEY YNQLUTRBYVCPMQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3020596

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$SPLASH: splash10-0006-9200000000-c2b5306fbaeb48134d6b
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  27 2.32 23
  39 5.06 51
  50 2.93 29
  51 9.15 92
  52 2.99 30
  63 2.62 26
  65 7.87 79
  77 7.5 75
  78 5.49 55
  79 3.97 40
  89 1.65 17
  91 99.99 999
  92 7.38 74
  103 3.05 31
  105 5.98 60
  106 32.95 330
  107 2.62 26
//

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