MassBank Record: JP006809



 CIS-3-HEXENYL ACETATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP006809
RECORD_TITLE: CIS-3-HEXENYL ACETATE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: TAJIMA SGUNMA COLLEGE OF TECHNOLOGY, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: CIS-3-HEXENYL ACETATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H14O2 CH$EXACT_MASS: 142.09938 CH$SMILES: CCC=CCCOC(C)=O CH$IUPAC: InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h4-5H,3,6-7H2,1-2H3/b5-4- CH$LINK: INCHIKEY NPFVOOAXDOBMCE-PLNGDYQASA-N
AC$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: splash10-0006-9000000000-92d448bb2099c2ca8a3e PK$NUM_PEAK: 21 PK$PEAK: m/z int. rel.int. 15 5.07 51 27 9.34 93 28 1.95 20 29 4.45 45 39 11.98 120 40 1.52 15 41 17.55 176 42 3.77 38 43 99.99 999 44 2.43 24 51 1.17 12 53 4.36 44 54 6.96 70 55 6.2 62 67 56.33 563 68 3.68 37 69 1.5 15 73 3.07 31 81 4.35 44 82 39.27 393 83 3.2 32 //