Spectrum CCMSLIB00000845361 for NCGC00247464-02!5,7-dihydroxy-8-methoxy-2-phenylchromen-4-one

Rating: (*)★(*)★(*)★(*)★(*)☆

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
n/a
n/a
InChI=1S/C16H12O5/c1-20-15-12(19)7-10(17)14-11(18)8-13(21-16(14)15)9-5-3-2-4-6-9/h2-8,17,19H,1H3
C16H12O5
284.068473484
O=C1C=C(OC=2C(OC)=C(O)C=C(O)C12)C=3C=CC=CC3
XLTFNNCXVBYBSX-UHFFFAOYSA-N

Mass Spectral Metadata

NameValue
LC-ESI
isolated
Maxis II HD Q-TOF Bruker
284.068
1
positive
A2_GA2_01_2900.mzXML
MS2
GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE
mwang87, Jadhav/Dorrestein, lfnothias
3.056978405685559
0.4799098783366433
285.075
[M+H]+
5.063523634103896 ppm
-0.0014434839999921678 Da