MassBank Record: JP001513



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

ACCESSION: JP001513
RECORD_TITLE: PHENYL BENZOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: PHENYL BENZOATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C13H10O2 CH$EXACT_MASS: 198.06808 CH$SMILES: O=C(Oc(c2)cccc2)c(c1)cccc1 CH$IUPAC: InChI=1S/C13H10O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H
AC$INSTRUMENT: HITACHI RMU-6M AC$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$SPLASH: splash10-0a4i-7900000000-c4339fd58280cab5aaf0 PK$NUM_PEAK: 18 PK$PEAK: m/z int. rel.int. 27 1.72 17 28 1.69 17 38 1.65 17 39 8.99 90 50 5.64 56 51 18.56 186 52 1.02 10 63 1.71 17 65 4.6 46 74 1.24 12 75 1.26 13 76 2.44 24 77 48.28 483 78 3.5 35 105 99.99 999 106 7.93 79 198 8.89 89 199 1.31 13 //