CID 44257616

5,7,2',5'-tetramethoxyflavone

Structural Information

Molecular Formula
C19H18O6
SMILES
COC1=CC(=C(C=C1)OC)C2=CC(=O)C3=C(O2)C=C(C=C3OC)OC
InChI
InChI=1S/C19H18O6/c1-21-11-5-6-15(23-3)13(7-11)16-10-14(20)19-17(24-4)8-12(22-2)9-18(19)25-16/h5-10H,1-4H3
InChIKey
LIOJFJYPMYGQFI-UHFFFAOYSA-N
Compound name
2-(2,5-dimethoxyphenyl)-5,7-dimethoxychromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

342.11035 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.11763 176.5
[M+Na]+ 365.09957 187.3
[M-H]- 341.10307 186.1
[M+NH4]+ 360.14417 190.2
[M+K]+ 381.07351 186.4
[M+H-H2O]+ 325.10761 167.6
[M+HCOO]- 387.10855 199.1
[M+CH3COO]- 401.12420 214.0
[M+Na-2H]- 363.08502 181.6
[M]+ 342.10980 186.8
[M]- 342.11090 186.8
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

No patent data available for this compound.