MassBank MassBank Search Contents Download

MassBank Record: TY000144

Luteolin; LC-ESI-ITTOF; MS; [M-H]-

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: TY000144
RECORD_TITLE: Luteolin; LC-ESI-ITTOF; MS; [M-H]-
DATE: 2016.01.19 (Created 2010.10.14, modified 2011.05.06)
AUTHORS: Toshimitsu HAYASHI, Ken TANAKA
LICENSE: CC BY-SA

CH$NAME: Luteolin
CH$NAME: 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
CH$NAME: 3',4',5,7-Tetrahydroxy-flavone
CH$NAME: 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4H-benzopyran-4-one
CH$NAME: 3',4',5,7-Tetrahydroxyflavone
CH$NAME: 5,7,3',4'-Tetrahydroxyflavone
CH$NAME: Cyanidenon
CH$NAME: Digitoflavone
CH$NAME: Flacitran
CH$NAME: Luteoline
CH$NAME: Luteolol
CH$NAME: Salifazide
CH$COMPOUND_CLASS: Natural Product; Flavonoid
CH$FORMULA: C15H10O6
CH$EXACT_MASS: 286.04774
CH$SMILES: Oc(c3)c(O)cc(c3)C(=C1)Oc(c2)c(c(O)cc(O)2)C(=O)1
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$LINK: INCHIKEY IQPNAANSBPBGFQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4074988

AC$INSTRUMENT: LCMS-IT-TOF
AC$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$MASS_SPECTROMETRY: SCANNING 0.1 sec/scan (m/z = 200-2000)
AC$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 14.539117 min
AC$CHROMATOGRAPHY: SOLVENT A 5 mM ammonium acetate
AC$CHROMATOGRAPHY: SOLVENT B CH3CN

MS$FOCUSED_ION: BASE_PEAK 285.032900

PK$SPLASH: splash10-0079-0090080000-7141ab1d540bde706a98
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  285.032900 9583932.000000 999
  285.195200 168052.000000 18
  285.341200 203015.000000 21
  285.552300 60845.000000 6
  286.039700 1751701.000000 183
  287.048200 169367.000000 18
  399.031400 1049019.000000 109
  400.030200 339412.000000 35
  553.044600 95431.000000 10
  569.068200 283217.000000 30
  570.077300 132399.000000 14
  571.087300 6955794.000000 725
  571.317000 119556.000000 12
  571.500700 132905.000000 14
  571.822400 94364.000000 10
  572.098200 2419145.000000 252
  573.086900 441755.000000 46
  574.076500 60845.000000 6
  593.064700 60845.000000 6
  623.997300 132399.000000 14
  625.005900 71306.000000 7
  791.350200 57643.000000 6
  910.034200 60845.000000 6
//

Imprint Feedback
system version 2.1.8
Copyright © 2006 MassBank Project; 2011 NORMAN Association; 2021 MassBank Consortium
Responsible: Dr. Tobias Schulze