MassBank Record: JP000033



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

ACCESSION: JP000033
RECORD_TITLE: CYCLOHEXANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: CYCLOHEXANOL CH$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$INSTRUMENT: VARIAN MAT-44 AC$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$SPLASH: splash10-0a4i-9000000000-366e255469d84fceed6e PK$NUM_PEAK: 19 PK$PEAK: m/z int. rel.int. 51 2.87 29 53 6.48 65 54 13.43 134 55 14.86 149 56 25.56 256 57 99.99 999 58 8.86 89 66 7.51 75 67 26.77 268 68 2.24 22 69 2.7 27 70 4.12 41 71 13.56 136 72 6.79 68 81 21 210 82 37.34 373 83 4.48 45 99 2.11 21 100 2.07 21 //