MassBank Record: PB005704



 Kaempferol; LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PB005704
RECORD_TITLE: Kaempferol; LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
DATE: 2016.01.19 (Created 2009.02.18, modified 2013.06.04)
AUTHORS: Heinz T, Institute of Plant Biochemistry, Halle, Germany
LICENSE: CC BY-SA
COMMENT: IPB_RECORD: 2141
COMMENT: CONFIDENCE: confident structure

CH$NAME: Kaempferol CH$NAME: 3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C15H10O6 CH$EXACT_MASS: 286.04774 CH$SMILES: C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O CH$IUPAC: InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H CH$LINK: INCHIKEY IYRMWMYZSQPJKC-UHFFFAOYSA-N CH$LINK: PUBCHEM CID:5280863
AC$INSTRUMENT: micrOTOF-Q AC$INSTRUMENT_TYPE: LC-ESI-QTOF AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 eV AC$MASS_SPECTROMETRY: IONIZATION ESI
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-000i-0090000000-bae5a8f4a371f8f2ad02 PK$NUM_PEAK: 36 PK$PEAK: m/z int. rel.int. 121.027 40.040 3 133.027 10.010 0 137.022 30.030 2 147.043 20.020 1 153.016 190.190 18 154.018 10.010 0 157.063 10.010 0 165.017 110.110 10 171.039 10.010 0 183.027 50.050 4 185.058 20.020 1 197.057 10.010 0 203.067 10.010 0 213.053 200.200 19 214.056 30.030 2 229.049 20.020 1 231.062 160.160 15 232.069 10.010 0 241.045 190.190 18 242.052 20.020 1 243.061 10.010 0 245.042 20.020 1 258.048 270.270 26 259.055 150.150 14 260.059 10.010 0 263.051 10.010 0 269.041 50.050 4 270.048 10.010 0 286.036 10.010 0 286.806 10.010 0 286.911 10.010 0 287.051 10000.000 999 287.233 10.010 0 287.424 10.010 0 288.053 1211.211 120 289.056 60.060 5 //