MassBank Record: JP003223



 2,2-DIPROPYL-5,5-DIMETHYL-1,3-CYCLOHEXANEDIONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003223
RECORD_TITLE: 2,2-DIPROPYL-5,5-DIMETHYL-1,3-CYCLOHEXANEDIONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKATA H, DEPT. OF CHEMISTRY, AICHI KYOIKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2,2-DIPROPYL-5,5-DIMETHYL-1,3-CYCLOHEXANEDIONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C14H24O2 CH$EXACT_MASS: 224.17763 CH$SMILES: CCCC(CCC)(C(=O)1)C(=O)CC(C)(C)C1 CH$IUPAC: InChI=1S/C14H24O2/c1-5-7-14(8-6-2)11(15)9-13(3,4)10-12(14)16/h5-10H2,1-4H3
AC$INSTRUMENT: HITACHI RMU-7 AC$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$SPLASH: splash10-001j-9600000000-b03a9dfeb6701b1bad21 PK$NUM_PEAK: 21 PK$PEAK: m/z int. rel.int. 41 45 450 43 18 180 55 31 310 69 23 230 82 6 60 83 99.99 999 84 16 160 97 35 350 98 15 150 111 15 150 126 18 180 149 10 100 153 10 100 154 17 170 165 7 70 167 33 330 168 10 100 182 32 320 195 32 320 196 9 90 224 9 90 //