ACCESSION: MSBNK-IPB_Halle-PB000742
RECORD_TITLE: Luteolin; LC-ESI-QTOF; MS2; CE:25 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
CH$LINK: COMPTOX DTXSID4074988

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$MASS_SPECTROMETRY: COLLISION_ENERGY 25 eV
AC$MASS_SPECTROMETRY: IONIZATION ESI

MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-000i-0090000000-32d872624745be3abab3
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  153.020 108.118 9
  287.056 10000.000 999
  288.062 466.012 45
//