CID 3040451

7-methoxy-8-morpholinomethyl-1-azaxanthone hydrochloride

Structural Information

Molecular Formula
C18H18N2O4
SMILES
COC1=C(C2=C(C=C1)C(=O)C3=C(O2)N=CC=C3)CN4CCOCC4
InChI
InChI=1S/C18H18N2O4/c1-22-15-5-4-12-16(21)13-3-2-6-19-18(13)24-17(12)14(15)11-20-7-9-23-10-8-20/h2-6H,7-11H2,1H3
InChIKey
CGSFNCVFIQMNHU-UHFFFAOYSA-N
Compound name
8-methoxy-9-(morpholin-4-ylmethyl)chromeno[2,3-b]pyridin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.12665 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.13393 174.8
[M+Na]+ 349.11587 191.9
[M+NH4]+ 344.16047 182.7
[M+K]+ 365.08981 184.3
[M-H]- 325.11937 181.8
[M+Na-2H]- 347.10132 181.4
[M]+ 326.12610 179.4
[M]- 326.12720 179.4
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.