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]+ 338.138676 179.2
[M+Na]+ 360.120618 186.2
[M-H]- 336.124124 188.1
[M+NH4]+ 355.165223 188.4
[M+K]+ 376.094558 183.2
[M+H-H2O]+ 320.128660 168.7
[M+HCOO]- 382.129601 194.3
[M+CH3COO]- 396.145251 189.1
[M+Na-2H]- 358.106066 184.1
[M]+ 337.13085142 178.4
[M]- 337.13194858 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.