MassBank Record: JP003130



 3,4,7-TRIMETHOXYCOUMARIN; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003130
RECORD_TITLE: 3,4,7-TRIMETHOXYCOUMARIN; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKAYAMA M, MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 3,4,7-TRIMETHOXYCOUMARIN CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H12O5 CH$EXACT_MASS: 236.06847 CH$SMILES: COc(c2)cc(O1)c(c2)C(OC)=C(OC)C(=O)1 CH$IUPAC: InChI=1S/C12H12O5/c1-14-7-4-5-8-9(6-7)17-12(13)11(16-3)10(8)15-2/h4-6H,1-3H3
AC$INSTRUMENT: HITACHI RMU-7L AC$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$SPLASH: splash10-000f-2960000000-50bec6607a443a8d1bcb PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 41 3 30 43 2 20 50 2 20 51 6 60 63 10 100 74 2 20 75 2 20 77 6 60 79 7 70 92 4 40 94 2 20 106 3 30 107 12 120 122 13 130 134 3 30 135 5 50 149 4 40 150 15 150 151 2 20 165 10 100 176 2 20 177 2 20 193 99.99 999 194 10 100 207 2 20 221 22 220 222 3 30 236 87 870 237 8 80 //