MassBank Record: JP006846



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

ACCESSION: JP006846
RECORD_TITLE: CIS-3-HEXENOL; 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$NAME: CIS-3-HEXENOL CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H12O CH$EXACT_MASS: 100.08882 CH$SMILES: CCC=CCCO CH$IUPAC: InChI=1S/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3- CH$LINK: INCHIKEY UFLHIIWVXFIJGU-ARJAWSKDSA-N
AC$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: splash10-00l6-9000000000-54ee041e574aedb72ec1 PK$NUM_PEAK: 37 PK$PEAK: m/z int. rel.int. 15 2.09 21 26 2.3 23 27 24.08 241 28 2.83 28 29 18.74 187 30 1.13 11 31 28.21 282 38 2.48 25 39 31.9 319 40 4.37 44 41 99.99 999 42 22.6 226 43 8.61 86 44 6.79 68 45 2.07 21 50 2.34 23 51 3.7 37 52 1.36 14 53 11.54 115 54 11.47 115 55 38.58 386 56 5.22 52 57 13.23 132 58 1.03 10 63 1 10 65 2.18 22 66 1.27 13 67 72.58 726 68 5.62 56 69 23.22 232 70 10.5 105 71 1.53 15 72 2.28 23 81 4.62 46 82 37.69 377 83 2.29 23 100 1.97 20 //