ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001195
RECORD_TITLE: PROPYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: PROPYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₁₀O₂
CH$EXACT_MASS: 102.06808
CH$SMILES: CCCOC(C)=O
CH$IUPAC: InChI=1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3
CH$LINK: INCHIKEY YKYONYBAUNKHLG-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6021901

AC$INSTRUMENT: HITACHI RMU-6D
AC$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$SPLASH: splash10-00kf-9000000000-eeea11594f16f50df38a
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  18 1.5 15
  26 1.5 15
  41 6 60
  42 1 10
  43 99.99 999
  44 2 20
  45 1 10
  55 3.2 32
  56 41 410
  57 6 60
  58 2 20
  61 1.25 13
  68 4 40
  69 68.5 685
  70 7 70
  71 2.9 29
  79 1.5 15
  97 2 20
  101 1.5 15
//