ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001675
RECORD_TITLE: BUTYLBENZENE; 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$NAME: BUTYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄
CH$EXACT_MASS: 134.10955
CH$SMILES: CCCCc(c1)cccc1
CH$IUPAC: InChI=1S/C10H14/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2-3,7H2,1H3
CH$LINK: INCHIKEY OCKPCBLVNKHBMX-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6022472

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$SPLASH: splash10-0006-9100000000-8aeafb9017bc190eb37e
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  27 4.2 42
  28 1.4 14
  29 1.33 13
  39 5.67 57
  41 3.71 37
  43 2.1 21
  50 1.47 15
  51 4.83 48
  52 1.26 13
  63 2.1 21
  65 10.71 107
  77 5.04 50
  78 5.18 52
  79 2.73 27
  89 1.54 15
  91 99.99 999
  92 49.9 499
  93 3.5 35
  103 1.75 18
  105 7.84 78
  134 22.04 220
  135 2.24 22
//