MassBank Record: JP002211



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

ACCESSION: JP002211
RECORD_TITLE: ALPHA-PHENYLPROPIONIC ACID METHYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: ALPHA-PHENYLPROPIONIC ACID METHYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H12O2 CH$EXACT_MASS: 164.08373 CH$SMILES: COC(=O)C(C)c(c1)cccc1 CH$IUPAC: InChI=1S/C10H12O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h3-8H,1-2H3
AC$INSTRUMENT: JEOL JMS-01-SG AC$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$SPLASH: splash10-0a4i-2900000000-65a5be1d1341a3fe58be PK$NUM_PEAK: 14 PK$PEAK: m/z int. rel.int. 50 2.2 22 51 4.5 45 52 1.4 14 63 0.17 2 70 8.7 87 77 10.8 108 78 3.1 31 79 1.17 12 103 7.5 75 104 4.3 43 105 99.99 999 106 0.92 9 164 19.6 196 165 2.4 24 //