MassBank Record: JP001202



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

ACCESSION: JP001202
RECORD_TITLE: SEC-BUTYL 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$NAME: SEC-BUTYL ACETATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H12O2 CH$EXACT_MASS: 116.08373 CH$SMILES: CCC(C)OC(C)=O CH$IUPAC: InChI=1S/C6H12O2/c1-4-5(2)8-6(3)7/h5H,4H2,1-3H3
AC$INSTRUMENT: HITACHI RMU-6D AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9000000000-90f2f52d6ddf554b8db5 PK$NUM_PEAK: 22 PK$PEAK: m/z int. rel.int. 14 5 50 18 10 100 25 6.5 65 26 0.7 7 27 10.5 105 29 1 10 39 4.5 45 40 0.15 2 41 14 140 42 2 20 43 99.99 999 44 0.25 3 45 3.5 35 55 24.5 245 56 8 80 61 0.4 4 72 1.5 15 73 6 60 88 20 200 89 0.25 3 101 3 30 115 1 10 //