MassBank Record: JP002523



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

ACCESSION: JP002523
RECORD_TITLE: PARA-METHOXYBENZYL ACETATE; 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$NAME: PARA-METHOXYBENZYL ACETATE CH$NAME: ANISYL ACETATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H12O3 CH$EXACT_MASS: 180.07864 CH$SMILES: COc(c1)ccc(COC(C)=O)c1 CH$IUPAC: InChI=1S/C10H12O3/c1-8(11)13-7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3
AC$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: splash10-00di-5900000000-085e2f064c20eae3deb2 PK$NUM_PEAK: 44 PK$PEAK: m/z int. rel.int. 14 1 10 15 6.45 65 27 1.55 16 28 1 10 29 1.24 12 38 1.74 17 39 6.54 65 40 1.19 12 41 1.93 19 43 25.96 260 50 3.8 38 51 8.95 90 52 5.16 52 53 1.55 16 55 1 10 62 1.21 12 63 4.92 49 64 3.7 37 65 4.51 45 66 2.39 24 76 1.41 14 77 18.71 187 78 12.11 121 79 2.27 23 89 5.82 58 90 6.61 66 91 16.93 169 92 5.78 58 94 3.8 38 105 5.63 56 106 2.65 27 107 3.44 34 109 8.19 82 119 3.65 37 120 42.12 421 121 99.99 999 122 9.46 95 135 3.58 36 136 1.05 11 137 6.97 70 138 18.52 185 139 1.74 17 180 43.13 431 181 4.94 49 //