MassBank Record: PB000744



 Luteolin; LC-ESI-QTOF; MS2; CE:55 eV; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PB000744
RECORD_TITLE: Luteolin; LC-ESI-QTOF; MS2; CE:55 eV; [M+H]+
DATE: 2016.01.19 (Created 2008.03.23, modified 2013.06.04)
AUTHORS: Boettcher C, Institute of Plant Biochemistry, Halle, Germany
LICENSE: CC BY-SA
COMMENT: IPB_RECORD: 361
COMMENT: CONFIDENCE: confident structure

CH$NAME: Luteolin CH$NAME: 5,7,3',4'-tetrahydroxy-flavone CH$COMPOUND_CLASS: Natural Product; Flavone CH$FORMULA: C15H10O6 CH$EXACT_MASS: 286.04774 CH$SMILES: C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O CH$IUPAC: InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H CH$LINK: INCHIKEY IQPNAANSBPBGFQ-UHFFFAOYSA-N CH$LINK: KEGG C01514 CH$LINK: PUBCHEM CID:5280445
AC$INSTRUMENT: API QSTAR Pulsar i AC$INSTRUMENT_TYPE: LC-ESI-QTOF AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 55 eV AC$MASS_SPECTROMETRY: IONIZATION ESI
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0uy0-2900000000-59881a247e3abd241d7b PK$NUM_PEAK: 52 PK$PEAK: m/z int. rel.int. 55.019 167.805 15 63.023 90.146 8 67.018 2025.756 201 68.997 2999.440 298 77.039 390.705 38 79.055 426.764 41 81.035 280.683 27 83.014 151.904 14 87.022 99.104 8 89.039 3101.344 309 91.054 95.633 8 97.030 372.788 36 103.054 93.673 8 105.035 199.720 18 107.049 353.471 34 109.027 258.679 24 111.008 357.055 34 115.053 1143.897 113 117.033 2449.608 243 121.029 106.215 9 125.024 362.094 35 127.049 466.573 45 128.060 1261.478 125 129.066 510.470 50 131.048 161.926 15 133.027 196.361 18 135.043 2515.677 250 137.025 1780.515 177 139.054 1973.124 196 143.045 266.349 25 145.062 261.646 25 147.042 257.559 24 153.018 10000.000 999 154.023 284.826 27 155.056 364.894 35 157.065 595.745 58 161.026 2645.017 263 167.053 284.826 27 168.060 117.973 10 171.047 673.012 66 179.040 136.226 12 184.058 210.358 20 185.064 479.115 46 187.044 114.670 10 195.048 253.919 24 203.038 103.583 9 212.050 342.553 33 213.059 482.643 47 229.052 156.775 14 240.044 164.334 15 241.054 743.561 73 287.055 464.894 45 //