MassBank Record: JP000545



 2-(2'-METHOXYPHENETHYL)CHROMONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000545
RECORD_TITLE: 2-(2'-METHOXYPHENETHYL)CHROMONE; 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$NAME: 2-(2'-METHOXYPHENETHYL)CHROMONE CH$NAME: 2-(ORTHO-METHOXYPHENETHYL)-4H-CHROMEN-4-ONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H16O3 CH$EXACT_MASS: 280.10994 CH$SMILES: COc(c3)c(ccc3)CCC(=C1)Oc(c2)c(ccc2)C(=O)1 CH$IUPAC: InChI=1S/C18H16O3/c1-20-17-8-4-2-6-13(17)10-11-14-12-16(19)15-7-3-5-9-18(15)21-14/h2-9,12H,10-11H2,1H3
AC$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: splash10-00e9-2960000000-5e0df07fce9af279ac2b PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 78 1.22 12 81 2.23 22 91 29.49 295 92 2.43 24 93 6.01 60 120 1.03 10 121 99.99 999 122 7.78 78 123 1.04 10 131 1.05 11 147 8.06 81 160 5.28 53 161 4.17 42 173 1.24 12 249 1.36 14 265 1.06 11 279 3.11 31 280 70.81 708 281 14.08 141 282 1.95 20 //