ACCESSION: MSBNK-RIKEN_ReSpect-PT104043
RECORD_TITLE: Flacitran, Weld Lake, Lutl, Digitoflavone, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one, 3',4',5,7-tetrahydroxyflavone, Yama kariyasu, Luteolin, 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-, Cyanidenon 1470, Luteolol; LC-ESI-QTOF; MS2
DATE: 2008.07.25
AUTHORS: Matsuda F, Suzuki M, Sawada Y, Plant Science Center, RIKEN.
LICENSE: CC BY-NC
COPYRIGHT: Copyright(C) 2009 Plant Science Center, RIKEN
COMMENT: Build 1 2009/06/24
COMMENT: Acquisition and generation of the data is financially supported in part by CREST/JST.

CH$NAME: Flacitran
CH$NAME: Weld Lake
CH$NAME: Lutl
CH$NAME: Digitoflavone
CH$NAME: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
CH$NAME: 3',4',5,7-tetrahydroxyflavone
CH$NAME: Yama kariyasu
CH$NAME: Luteolin
CH$NAME: 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-
CH$NAME: Cyanidenon 1470
CH$NAME: Luteolol
CH$COMPOUND_CLASS: CLASS1 Flavonoid CLASS2 Flavone CLASS3 Luteolin
CH$FORMULA: C₁₅H₁₀O₆
CH$EXACT_MASS: 286.239
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$LINK: CAS 491-70-3
CH$LINK: INCHIKEY IQPNAANSBPBGFQ-UHFFFAOYSA-N

AC$INSTRUMENT: Q-Tof Premier, Waters
AC$INSTRUMENT_TYPE: LC-ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
AC$MASS_SPECTROMETRY: CAPILLARY_VOLTAGE 3.0 kV
AC$CHROMATOGRAPHY: SOLVENT CH3CN/H2O

MS$FOCUSED_ION: ION_TYPE [M+H]+
MS$FOCUSED_ION: PRECURSOR_M/Z 287.05554

PK$SPLASH: splash10-0f79-1920000000-42c47240052ab59116f7
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  67.0193 60.84 127
  68.9974 63.09 132
  89.0394 67.35 141
  117.0346 82.26 172
  135.0449 177.2 371
  137.024 62.15 130
  153.0186 477.7 999
  161.0244 73.6 154
  241.0493 65.08 136
  287.0555 224.6 470
//