MassBank Record: JP009724



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

ACCESSION: JP009724
RECORD_TITLE: BENZOIC ACID ETHYL ESTER; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: HASHIMOTO KKYOTO COLLEGE OF PHARMACY, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: BENZOIC ACID ETHYL ESTER CH$NAME: ETHYL BENZOATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H10O2 CH$EXACT_MASS: 150.06808 CH$SMILES: CCOC(=O)c(c1)cccc1 CH$IUPAC: InChI=1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3 CH$LINK: INCHIKEY MTZQAGJQAFMTAQ-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-80 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-1900000000-f9719df41d062495f650 PK$NUM_PEAK: 14 PK$PEAK: m/z int. rel.int. 29 2.3 23 45 1.57 16 51 2.35 24 77 26.7 267 78 2.91 29 91 1.12 11 105 99.99 999 106 9.56 96 122 35.2 352 123 2.91 29 135 1.26 13 149 2.18 22 150 24.23 242 151 2.45 25 //