MassBank Record: JP000665



 5,7-DIMETHYL-3-HYDROXYIMINO-3'4'-METHYLENEDOXYFLAVANONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000665
RECORD_TITLE: 5,7-DIMETHYL-3-HYDROXYIMINO-3'4'-METHYLENEDOXYFLAVANONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKATORI M, DEPT. OF CHEMISTRY, FAC. OF EDUC., FUKUSHIMA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 5,7-DIMETHYL-3-HYDROXYIMINO-3'4'-METHYLENEDOXYFLAVANONE CH$NAME: 3-HYDROXYIMINO-5,7-DIMETHYL-2-(3,4-METHYLENEDIOXYPHENYL)CHROMAN-4-ONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H15NO5 CH$EXACT_MASS: 325.09502 CH$SMILES: ON=C(C(=O)3)C(Oc(c4)c(c(C)cc(C)4)3)c(c1)cc(O2)c(OC2)c1 CH$IUPAC: InChI=1S/C18H15NO5/c1-9-5-10(2)15-14(6-9)24-18(16(19-21)17(15)20)11-3-4-12-13(7-11)23-8-22-12/h3-7,18,21H,8H2,1-2H3/b19-16+
AC$INSTRUMENT: JEOL JMS-06-H AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03dj-2709000000-a767e5fe1f9d19b91c51 PK$NUM_PEAK: 34 PK$PEAK: m/z int. rel.int. 32 4 40 39 3.8 38 51 4.1 41 53 0.23 2 63 8.1 81 65 10.2 102 76 4.2 42 77 0.94 9 91 15.8 158 103 4.4 44 104 5.3 53 119 0.58 6 120 3.8 38 121 5.8 58 122 4.8 48 132 0.41 4 140 5.1 51 148 12.1 121 149 85 850 150 0.58 6 160 10.2 102 161 11.3 113 165 15.1 151 166 1.35 14 176 8.6 86 177 2.7 27 224 3.5 35 281 0.29 3 282 4.3 43 303 28.3 283 309 59.3 593 310 99.99 999 311 16.4 164 325 8.5 85 //