CID 688812

3,6,3',4'-tetramethoxyflavone

Structural Information

Molecular Formula
C19H18O6
SMILES
COC1=CC2=C(C=C1)OC(=C(C2=O)OC)C3=CC(=C(C=C3)OC)OC
InChI
InChI=1S/C19H18O6/c1-21-12-6-8-14-13(10-12)17(20)19(24-4)18(25-14)11-5-7-15(22-2)16(9-11)23-3/h5-10H,1-4H3
InChIKey
IEWBNRYNNVFPME-UHFFFAOYSA-N
Compound name
2-(3,4-dimethoxyphenyl)-3,6-dimethoxychromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

27
Patents

342.11035 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.11763 176.3
[M+Na]+ 365.09957 193.0
[M+NH4]+ 360.14417 183.6
[M+K]+ 381.07351 186.0
[M-H]- 341.10307 182.0
[M+Na-2H]- 363.08502 183.5
[M]+ 342.10980 180.5
[M]- 342.11090 180.5
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