CID 12411392

7,8-dihydroxy-4'-methoxyflavone

Structural Information

Molecular Formula
C16H12O5
SMILES
COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3)O)O
InChI
InChI=1S/C16H12O5/c1-20-10-4-2-9(3-5-10)14-8-13(18)11-6-7-12(17)15(19)16(11)21-14/h2-8,17,19H,1H3
InChIKey
RURKPPYMSHZUEY-UHFFFAOYSA-N
Compound name
7,8-dihydroxy-2-(4-methoxyphenyl)chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

284.06848 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.07576 160.8
[M+Na]+ 307.05770 177.2
[M+NH4]+ 302.10230 168.5
[M+K]+ 323.03164 170.7
[M-H]- 283.06120 166.0
[M+Na-2H]- 305.04315 168.3
[M]+ 284.06793 164.7
[M]- 284.06903 164.7
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