CID 5310763

7-hydroxy-8-(morpholinomethyl)isoflavone hydrochloride

Structural Information

Molecular Formula
C20H19NO4
SMILES
C1COCCN1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O
InChI
InChI=1S/C20H19NO4/c22-18-7-6-15-19(23)17(14-4-2-1-3-5-14)13-25-20(15)16(18)12-21-8-10-24-11-9-21/h1-7,13,22H,8-12H2
InChIKey
VFWZRNWEXUGWGH-UHFFFAOYSA-N
Compound name
7-hydroxy-8-(morpholin-4-ylmethyl)-3-phenylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

337.1314 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.13868 178.9
[M+Na]+ 360.12062 195.4
[M+NH4]+ 355.16522 186.8
[M+K]+ 376.09456 187.7
[M-H]- 336.12412 187.6
[M+Na-2H]- 358.10607 186.8
[M]+ 337.13085 183.9
[M]- 337.13195 183.9
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.