MassBank Record: JP002545



 N-PROPYL BUTYRATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002545
RECORD_TITLE: N-PROPYL BUTYRATE; 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$NAME: N-PROPYL BUTYRATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H14O2 CH$EXACT_MASS: 130.09938 CH$SMILES: CCCOC(=O)CCC CH$IUPAC: InChI=1S/C7H14O2/c1-3-5-7(8)9-6-4-2/h3-6H2,1-2H3
AC$INSTRUMENT: HITACHI RMU-6M AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0076-9000000000-e720d1b1a41e521965bf PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 15 2.79 28 26 1.85 19 27 27.21 272 28 3.74 37 29 5.47 55 31 6.43 64 39 10.26 103 40 1.85 19 41 27.88 279 42 18.5 185 43 88.46 885 44 2.99 30 45 1.46 15 55 2.22 22 57 1.48 15 59 6.28 63 60 14.59 146 61 10.18 102 71 99.99 999 72 4.88 49 73 9.24 92 87 1.18 12 88 4.94 49 89 65.77 658 90 3.13 31 100 1.16 12 101 5.96 60 102 4.96 50 130 0.32 3 //