MassBank Record: JP001524



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

ACCESSION: JP001524
RECORD_TITLE: SEC-BUTYL 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$NAME: SEC-BUTYL ACETATE CH$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$INSTRUMENT: HITACHI RMU-6M AC$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$SPLASH: splash10-0006-9000000000-fe9fbf0a38e9d2dfce0a PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 15 4.92 49 27 5.44 54 28 2.28 23 29 8.55 86 31 1.14 11 39 3.11 31 41 11.45 115 42 1.71 17 43 99.99 999 44 2.69 27 45 3.26 33 55 2.43 24 56 20.41 204 57 6.56 66 61 4.56 46 72 1.24 12 73 5.49 55 87 16.58 166 101 3.21 32 116 0.62 6 //