MassBank Record: TY000023



 Wogonin; LC-ESI-ITTOF; MS; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: TY000023
RECORD_TITLE: Wogonin; LC-ESI-ITTOF; MS; [M-H]-
DATE: 2016.01.19 (2008.09.24, 2011.05.06)
AUTHORS: Ken TANAKA
LICENSE: CC BY-SA

CH$NAME: Wogonin CH$NAME: 4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-methoxy-2-phenyl- CH$NAME: Flavone, 5,7-dihydroxy-8-methoxy- CH$NAME: 5,7-Dihydroxy-8-methoxyflavone CH$NAME: Vogonin CH$NAME: Norwogonin 8-methyl ether CH$NAME: AIDS001403 CH$NAME: BRN 0287152 CH$NAME: NSC717845 CH$COMPOUND_CLASS: Natural Product; Flavonoid CH$FORMULA: C16H12O5 CH$EXACT_MASS: 284.06847 CH$SMILES: COc(c(O)3)c(O1)c(c(O)c3)C(=O)C=C(c(c2)cccc2)1 CH$IUPAC: InChI=1S/C16H12O5/c1-20-15-12(19)7-10(17)14-11(18)8-13(21-16(14)15)9-5-3-2-4-6-9/h2-8,17,19H,1H3 CH$LINK: CAS 632-85-9 CH$LINK: NIKKAJI J12.474E CH$LINK: PUBCHEM CID:5281703 CH$LINK: INCHIKEY XLTFNNCXVBYBSX-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID70212557
AC$INSTRUMENT: Shimadzu LC20A-IT-TOFMS AC$INSTRUMENT_TYPE: LC-ESI-ITTOF AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: CDL_TEMPERATURE 200 C AC$MASS_SPECTROMETRY: INTERFACE_VOLTAGE -3.50 kV AC$MASS_SPECTROMETRY: SCANNING 0.1 sec/scan (m/z = 150-2000) AC$CHROMATOGRAPHY: COLUMN_NAME Waters Atlantis T3 (2.1 x 150 mm, 5 um) AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 40 C AC$CHROMATOGRAPHY: FLOW_GRADIENT 10 % B to 100 % B/40 min AC$CHROMATOGRAPHY: FLOW_RATE 0.2 ml/min AC$CHROMATOGRAPHY: RETENTION_TIME 1165.899 sec AC$CHROMATOGRAPHY: SOLVENT (A)5 mM ammonium acetate, (B)CH3CN
MS$FOCUSED_ION: ION_TYPE [M-H]-
PK$SPLASH: splash10-001i-0090000000-5d725d61497f9b016320 PK$NUM_PEAK: 3 PK$PEAK: m/z int. rel.int. 268.0370 53359067 253 283.0596 210754729 999 284.0622 38406950 182 //

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