CID 49702

7-hydroxy-8-morpholinomethylflavone hydrochloride

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
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 179.2
[M+Na]+ 360.12062 186.2
[M-H]- 336.12412 188.1
[M+NH4]+ 355.16522 188.4
[M+K]+ 376.09456 183.2
[M+H-H2O]+ 320.12866 168.7
[M+HCOO]- 382.12960 194.3
[M+CH3COO]- 396.14525 189.1
[M+Na-2H]- 358.10607 184.1
[M]+ 337.13085 178.4
[M]- 337.13195 178.4
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.