CID 14585506

4',5-dihydroxy-7,8-dimethoxyflavone

Structural Information

Molecular Formula
C17H14O6
SMILES
COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=C(C=C3)O)OC
InChI
InChI=1S/C17H14O6/c1-21-14-8-12(20)15-11(19)7-13(23-17(15)16(14)22-2)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3
InChIKey
FTFPXINQVCVDEY-UHFFFAOYSA-N
Compound name
5-hydroxy-2-(4-hydroxyphenyl)-7,8-dimethoxychromen-4-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

7
Patents

314.07904 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.08632 168.5
[M+Na]+ 337.06826 184.6
[M+NH4]+ 332.11286 175.5
[M+K]+ 353.04220 178.7
[M-H]- 313.07176 173.3
[M+Na-2H]- 335.05371 175.1
[M]+ 314.07849 172.3
[M]- 314.07959 172.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe