CID 42608089

3'-hydroxy-5,7,4'-trimethoxy-8-c-methylflavanone

Structural Information

Molecular Formula
C19H20O6
SMILES
CC1=C2C(=C(C=C1OC)OC)C(=O)CC(O2)C3=CC(=C(C=C3)OC)O
InChI
InChI=1S/C19H20O6/c1-10-15(23-3)9-17(24-4)18-13(21)8-16(25-19(10)18)11-5-6-14(22-2)12(20)7-11/h5-7,9,16,20H,8H2,1-4H3
InChIKey
PWZSUNQCPBOCBW-UHFFFAOYSA-N
Compound name
2-(3-hydroxy-4-methoxyphenyl)-5,7-dimethoxy-8-methyl-2,3-dihydrochromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.12598 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.13326 178.0
[M+Na]+ 367.11520 187.3
[M-H]- 343.11870 185.9
[M+NH4]+ 362.15980 191.1
[M+K]+ 383.08914 186.0
[M+H-H2O]+ 327.12324 169.9
[M+HCOO]- 389.12418 196.3
[M+CH3COO]- 403.13983 213.8
[M+Na-2H]- 365.10065 180.4
[M]+ 344.12543 184.3
[M]- 344.12653 184.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.