CID 49698

4'-methoxy-3-methyl-3'-(morpholinomethyl)flavone hydrochloride

Structural Information

Molecular Formula
C22H23NO4
SMILES
CC1=C(OC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)OC)CN4CCOCC4
InChI
InChI=1S/C22H23NO4/c1-15-21(24)18-5-3-4-6-20(18)27-22(15)16-7-8-19(25-2)17(13-16)14-23-9-11-26-12-10-23/h3-8,13H,9-12,14H2,1-2H3
InChIKey
BVQQFVHBHXMHFY-UHFFFAOYSA-N
Compound name
2-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-3-methylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.16272 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.17000 187.3
[M+Na]+ 388.15194 204.3
[M+NH4]+ 383.19654 195.3
[M+K]+ 404.12588 196.0
[M-H]- 364.15544 196.6
[M+Na-2H]- 386.13739 195.1
[M]+ 365.16217 192.7
[M]- 365.16327 192.7
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.