ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007066
RECORD_TITLE: PROPYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
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$LINK: CAS 109-60-4
CH$LINK: INCHIKEY YKYONYBAUNKHLG-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6021901

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$SPLASH: splash10-0006-9000000000-4de83bd1697d62bc041f
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  14 1.02 10
  15 6.53 65
  26 1.17 12
  27 8.76 88
  28 1.2 12
  29 4.26 43
  31 3.69 37
  39 3.92 39
  41 7.25 73
  42 8.87 89
  43 99.99 999
  44 1.95 20
  59 4.39 44
  61 25.36 254
  73 12.12 121
//