ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005175
RECORD_TITLE: PROPYL ACETATE; EI-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$NAME: PROPYL ACETATE
CH$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$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0006-9000000000-4d6b615a7391ff485f70
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  28 1.47 15
  29 1.18 12
  31 2.72 27
  41 4.2 42
  42 11.2 112
  43 99.99 999
  44 2.35 24
  57 1.62 16
  59 7.58 76
  60 1 10
  61 47.06 471
  62 1.18 12
  72 2.05 21
  73 20.4 204
  102 0.59 6
//