Spectrum FiehnHILIC000461 for Kaempferol

Rating: (*)★(*)★(*)★(*)★(*)★
  • Originally submitted to the Fiehn Lab HILIC Library

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
C15H10O6
IYRMWMYZSQPJKC-UHFFFAOYSA-N
286.04773804
O=C1C(O)=C(OC=2C=C(O)C=C(O)C12)C=3C=CC(O)=CC3
InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H

Mass Spectral Metadata

NameValue
M + 0
1.39965
positive
HCD (NCE 20-30-40%)
180
LC-ESI-QFT
MS2
Thermo Q Exactive HF
Michael Sa and Megan Showalter
Waters Acquity UPLC BEH Amide column (2.1 x 150mm: 1.7µm)
1.7556686708964129
0.4443331760680993
287.0547
[M+H]+
3.5116651982632106 ppm
-0.0010080399999878864 Da