Spectrum MetaboBASE0100 for Luteolin

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
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
IQPNAANSBPBGFQ-UHFFFAOYSA-N
C15H10O6
286.04773804
O=C1C=C(OC=2C=C(O)C=C(O)C12)C=3C=CC(O)=C(O)C3

Mass Spectral Metadata

NameValue
License CC-BY-NC-SA 4.0 International
Plant Biology, The Noble Foundation, Ardmore, OK, US/Dennis Fine, Daniel Wherritt, and Lloyd Sumner
LC-ESI-TOF
impact HD
ESI
negative
MS2
Nitrogen
30
30
0.022
2013-08-01 02:53:04+02:00
Waters Acquity BEH C18 1.7um x 2.1 x 150 mm
490.01
D:\Data\Confirmed Standards\Reanalyzed MRM multiple CID\Luteolin (vial 10).d
1.8884895943752116
0.5796297231640716
285.048
[M-H]-
26.44452864071733 ppm
0.0075379599999791935 Da