ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012200
RECORD_TITLE: CIS-2-HEXENE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: IIDA Y, DAISHIMA S, FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: CIS-2-HEXENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₂
CH$EXACT_MASS: 84.09390
CH$SMILES: CCCC=CC
CH$IUPAC: InChI=1S/C6H12/c1-3-5-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+
CH$LINK: CAS 4050-45-7
CH$LINK: INCHIKEY RYPKRALMXUUNKS-HWKANZROSA-N
CH$LINK: COMPTOX DTXSID90881224

AC$INSTRUMENT: FINNIGAN-MAT 4500
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-053i-9000000000-174fd8c26d4011a793cf
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  55 14.83 148
  56 2.08 21
  57 43.36 434
  58 1.99 20
  69 31.43 314
  70 2.23 22
  71 29.73 297
  72 1.79 18
  83 77.61 776
  84 17.23 172
  85 99.99 999
  86 6.7 67
//