ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005181
RECORD_TITLE: VINYL PROPIONATE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: VINYL PROPIONATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₈O₂
CH$EXACT_MASS: 100.05243
CH$SMILES: C=COC(=O)CC
CH$IUPAC: InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h4H,2-3H2,1H3
CH$LINK: INCHIKEY UIWXSTHGICQLQT-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9051537

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-0udi-0900000000-abe66c81a61a79a52ce1
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  73 0.81 8
  75 1 10
  83 1.45 15
  99 1.44 14
  100 4.53 45
  101 99.99 999
  102 7.88 79
  103 1.31 13
//