ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006809
RECORD_TITLE: CIS-3-HEXENYL ACETATE; 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$NAME: CIS-3-HEXENYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₄O₂
CH$EXACT_MASS: 142.09938
CH$SMILES: CCC=CCCOC(C)=O
CH$IUPAC: InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h4-5H,3,6-7H2,1-2H3/b5-4-
CH$LINK: INCHIKEY NPFVOOAXDOBMCE-PLNGDYQASA-N
CH$LINK: COMPTOX DTXSID0041484

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0006-9000000000-92d448bb2099c2ca8a3e
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 5.07 51
  27 9.34 93
  28 1.95 20
  29 4.45 45
  39 11.98 120
  40 1.52 15
  41 17.55 176
  42 3.77 38
  43 99.99 999
  44 2.43 24
  51 1.17 12
  53 4.36 44
  54 6.96 70
  55 6.2 62
  67 56.33 563
  68 3.68 37
  69 1.5 15
  73 3.07 31
  81 4.35 44
  82 39.27 393
  83 3.2 32
//