MassBank Record: JP001312



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

ACCESSION: JP001312
RECORD_TITLE: ACETIC ACID META-TOLYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: ACETIC ACID META-TOLYL ESTER CH$NAME: META-CRESOL ACETATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H10O2 CH$EXACT_MASS: 150.06808 CH$SMILES: CC(=O)Oc(c1)cc(C)cc1 CH$IUPAC: InChI=1S/C9H10O2/c1-7-4-3-5-9(6-7)11-8(2)10/h3-6H,1-2H3
AC$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: splash10-0a4i-5900000000-7301945c166e8a5a537b PK$NUM_PEAK: 24 PK$PEAK: m/z int. rel.int. 15 3.6 36 27 2.72 27 38 1.24 12 39 5.96 60 42 1 10 43 21.37 214 50 2.07 21 51 4.37 44 52 2.42 24 53 2.95 30 63 2.13 21 65 2.13 21 77 9.45 95 78 3.01 30 79 9.45 95 80 5.25 53 90 5.9 59 91 3.31 33 106 1.12 11 107 35.3 353 108 99.99 999 109 7.56 76 150 11.45 115 151 1.24 12 //