MassBank Record: JP010713



 1,2,3-TRIMETHOXYBENZENE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP010713
RECORD_TITLE: 1,2,3-TRIMETHOXYBENZENE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: SUMITA YKYOTO COLLEGE OF PHARMACY, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: 1,2,3-TRIMETHOXYBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H12O3 CH$EXACT_MASS: 168.07864 CH$SMILES: COc(c1)c(OC)c(OC)cc1 CH$IUPAC: InChI=1S/C9H12O3/c1-10-7-5-4-6-8(11-2)9(7)12-3/h4-6H,1-3H3 CH$LINK: INCHIKEY CRUILBNAQILVHZ-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID1060899
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$SPLASH: splash10-0gb9-1900000000-7b940fb9c589a1b99aef PK$NUM_PEAK: 24 PK$PEAK: m/z int. rel.int. 39 1.43 14 65 4.8 48 67 1.54 15 77 3.56 36 82 2.1 21 92 1.03 10 93 12.67 127 94 1.12 11 95 12.51 125 107 2.23 22 108 3.79 38 110 22.13 221 111 1.58 16 122 1 10 125 25.42 254 126 2.04 20 137 1 10 138 2.73 27 152 1.38 14 153 52.23 522 154 4.86 49 168 99.99 999 169 9.93 99 170 1.07 11 //

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