MassBank Record: JP006787



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

ACCESSION: JP006787
RECORD_TITLE: DIBENZOYLMETHANE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: TAJIMA SGUNMA COLLEGE OF TECHNOLOGY, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: DIBENZOYLMETHANE CH$NAME: 1,3-DIPHENYL-1,3-PROPANDIONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H12O2 CH$EXACT_MASS: 224.08373 CH$SMILES: O=C(CC(=O)c(c2)cccc2)c(c1)cccc1 CH$IUPAC: InChI=1S/C15H12O2/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13/h1-10H,11H2 CH$LINK: INCHIKEY NZZIMKJIVMHWJC-UHFFFAOYSA-N
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$SPLASH: splash10-05i0-9870000000-2b6cb690ca482b354165 PK$NUM_PEAK: 30 PK$PEAK: m/z int. rel.int. 27 1.42 14 39 4.31 43 43 2.95 30 50 5.54 55 51 21.54 215 52 2.4 24 63 2.46 25 65 5.42 54 69 51.75 518 70 1.85 19 76 4.62 46 77 68.31 683 78 8.98 90 89 4 40 91 4.31 43 103 2.77 28 105 99.99 999 106 8 80 121 2.77 28 122 4.92 49 147 45.05 451 148 4.55 46 162 2.34 23 195 1.11 11 196 1.23 12 207 2.58 26 208 1.85 19 223 72.92 729 224 70.65 707 225 11.08 111 //