MassBank Record: JP001417



 4-HYDROXY-3-(3-OXO-1-PHENYLBUTYL)-2H-CHROMEN-2-ONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001417
RECORD_TITLE: 4-HYDROXY-3-(3-OXO-1-PHENYLBUTYL)-2H-CHROMEN-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: 4-HYDROXY-3-(3-OXO-1-PHENYLBUTYL)-2H-CHROMEN-2-ONE CH$NAME: 3-(1'-PHENYL-1'-ACETONYLMETHYL)-2-ONE-4-HYDROXY-BENZOPYRAN CH$COMPOUND_CLASS: N/A CH$FORMULA: C19H16O4 CH$EXACT_MASS: 308.10486 CH$SMILES: CC(=O)CC(c(c3)cccc3)C(C(=O)1)=C(O)c(c2)c(ccc2)O1 CH$IUPAC: InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3
AC$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: splash10-014i-0293000000-848341bcbd6a3f0a2c6b PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 18 1.2 12 120 1.3 13 121 3.7 37 131 0.26 3 134 1.1 11 145 4.5 45 146 1.8 18 147 0.1 1 162 1.4 14 187 10.3 103 188 1.3 13 249 0.29 3 250 1.5 15 251 4.8 48 265 99.99 999 266 2.04 20 267 2.8 28 308 30.4 304 309 6.5 65 310 1 10 //