ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008198
RECORD_TITLE: 3-METHYL-3-BUTEN-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 3-METHYL-3-BUTEN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H8O
CH$EXACT_MASS: 84.05751
CH$SMILES: CC(=C)C(C)=O
CH$IUPAC: InChI=1S/C5H8O/c1-4(2)5(3)6/h1H2,2-3H3
CH$LINK: INCHIKEY ZGHFDIIVVIFNPS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9052557
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9000000000-53fa2e3086e046074852
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  39 22.3 223
  41 99.99 999
  42 1.64 16
  43 76.07 761
  69 36.07 361
  70 1.64 16
  84 23.28 233
//
