MassBank Record: JP003138



 3,9,10-TRIMETHOXYPTEROCARPAN; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003138
RECORD_TITLE: 3,9,10-TRIMETHOXYPTEROCARPAN; 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$NAME: 3,9,10-TRIMETHOXYPTEROCARPAN CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H18O5 CH$EXACT_MASS: 314.11542 CH$SMILES: COc(c4)cc(O3)c(c4)C([H])(O1)C([H])(C3)c(c2)c(c(OC)c(OC)c2)1 CH$IUPAC: InChI=1S/C18H18O5/c1-19-10-4-5-12-15(8-10)22-9-13-11-6-7-14(20-2)18(21-3)17(11)23-16(12)13/h4-8,13,16H,9H2,1-3H3/t13-,16-/m0/s1
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$SPLASH: splash10-03di-0903000000-a36c79f59828ef0083bb PK$NUM_PEAK: 24 PK$PEAK: m/z int. rel.int. 115 12 120 123 11 110 127 19 190 128 34 340 133 25 250 137 25 250 139 18 180 147 14 140 148 45 450 151 18 180 152 9 90 157 34 340 161 41 410 162 10 100 165 13 130 166 16 160 168 9 90 178 18 180 185 9 90 191 10 100 299 21 210 313 19 190 314 99.99 999 315 16 160 //