MassBank Record: JP002375



 2-BENZYL-2-METHYLCYCLOHEXANONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002375
RECORD_TITLE: 2-BENZYL-2-METHYLCYCLOHEXANONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 2-BENZYL-2-METHYLCYCLOHEXANONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C14H18O CH$EXACT_MASS: 202.13577 CH$SMILES: c(c2)ccc(c2)CC(C)(C1)C(=O)CCC1 CH$IUPAC: InChI=1S/C14H18O/c1-14(10-6-5-9-13(14)15)11-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3
AC$INSTRUMENT: JEOL JMS-D-3000 AC$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$SPLASH: splash10-0006-9310000000-e9984670fb1e5b012086 PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 44 3.27 33 51 3.4 34 55 14.79 148 65 7.55 76 67 3.71 37 77 4.09 41 83 7.11 71 91 99.99 999 92 13.91 139 105 3.65 37 111 3.33 33 115 3.84 38 117 8.62 86 118 2.95 30 129 4.03 40 131 4.59 46 143 6.54 65 145 3.71 37 158 4.53 45 159 9.82 98 187 5.41 54 202 23.36 234 203 4.53 45 //