MassBank Record: JP001811



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

ACCESSION: JP001811
RECORD_TITLE: CYCLOHEXANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: CYCLOHEXANOL CH$NAME: CYCLOHEXYL ALCOHOL CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H12O CH$EXACT_MASS: 100.08882 CH$SMILES: OC(C1)CCCC1 CH$IUPAC: InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2
AC$INSTRUMENT: HITACHI RMU-7M 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: splash10-0a4i-9000000000-6f29b4ae6194ec13d2c2 PK$NUM_PEAK: 30 PK$PEAK: m/z int. rel.int. 27 8.91 89 28 3.24 32 29 9.88 99 31 4.78 48 39 9.96 100 40 1.62 16 41 20.65 207 42 7.29 73 43 10.12 101 44 22.27 223 45 3.24 32 51 1.3 13 53 3.16 32 54 10.36 104 55 9.39 94 56 12.96 130 57 99.99 999 58 7.94 79 67 24.94 249 68 1.54 15 69 1.78 18 70 1.21 12 71 13.12 131 72 6.8 68 79 1.3 13 81 4.53 45 82 46.96 470 83 4.29 43 99 1.05 11 100 2.43 24 //