MassBank Record: JP006904



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

ACCESSION: JP006904
RECORD_TITLE: O-METHYLBENZYL ACETATE; 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$NAME: O-METHYLBENZYL ACETATE CH$NAME: 1-ACETOXYMETHYL-2-METHYLBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H12O2 CH$EXACT_MASS: 164.08373 CH$SMILES: CC(=O)OCc(c1)c(C)ccc1 CH$IUPAC: InChI=1S/C10H12O2/c1-8-5-3-4-6-10(8)7-12-9(2)11/h3-6H,7H2,1-2H3 CH$LINK: INCHIKEY BKKDUUVBVHYZFA-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-80B AC$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$SPLASH: splash10-0udi-5900000000-78ff90a7a4c5e2dccf1e PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 15 2.95 30 27 2.01 20 39 5.71 57 41 1.13 11 43 20.57 206 50 1.5 15 51 4.77 48 52 1.35 14 53 1.3 13 63 3.12 31 65 5.95 60 77 12.11 121 78 11.37 114 79 6.52 65 89 1.78 18 91 8.6 86 93 3.79 38 102 1.1 11 103 11.23 112 104 99.99 999 105 28.87 289 106 2.48 25 107 7.11 71 119 1.54 15 121 1.11 11 122 4.06 41 //