MassBank Record: JP001226



 1,2-CYCLOHEXYLENE DIACETATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001226
RECORD_TITLE: 1,2-CYCLOHEXYLENE DIACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 1,2-CYCLOHEXYLENE DIACETATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H16O4 CH$EXACT_MASS: 200.10486 CH$SMILES: CC(=O)OC(C1)C(CCC1)OC(C)=O CH$IUPAC: InChI=1S/C10H16O4/c1-7(11)13-9-5-3-4-6-10(9)14-8(2)12/h9-10H,3-6H2,1-2H3
AC$INSTRUMENT: HITACHI RMU-6D AC$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$SPLASH: splash10-0007-9200000000-591eb504bfcdbfb1b86b PK$NUM_PEAK: 35 PK$PEAK: m/z int. rel.int. 16 6 60 18 5.5 55 19 16 160 27 0.3 3 28 4 40 29 2 20 39 4 40 41 0.7 7 42 2 20 43 99.99 999 44 3 30 55 0.15 2 57 3 30 61 4 40 66 3 30 68 0.4 4 69 8 80 77 5 50 78 3.5 35 79 0.2 2 81 3.5 35 96 18 180 97 42 420 98 0.3 3 110 1 10 111 20 200 112 2 20 114 1.4 14 115 6 60 123 1 10 131 2 20 141 7.35 74 142 7 70 157 8 80 158 6.5 65 //