CID 3070291

4-(2-hydroxy-3-(4-morpholinyl)propyl)-2-methyl-2h-pyrido(3,2-b)-1,4-oxazin-3(4h)-one

Structural Information

Molecular Formula
C15H21N3O4
SMILES
CC1C(=O)N(C2=C(O1)C=CC=N2)CC(CN3CCOCC3)O
InChI
InChI=1S/C15H21N3O4/c1-11-15(20)18(14-13(22-11)3-2-4-16-14)10-12(19)9-17-5-7-21-8-6-17/h2-4,11-12,19H,5-10H2,1H3
InChIKey
JTFBJGNRBIEOSN-UHFFFAOYSA-N
Compound name
4-(2-hydroxy-3-morpholin-4-ylpropyl)-2-methylpyrido[3,2-b][1,4]oxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.1532 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.16048 174.2
[M+Na]+ 330.14242 178.8
[M-H]- 306.14592 176.3
[M+NH4]+ 325.18702 181.9
[M+K]+ 346.11636 177.5
[M+H-H2O]+ 290.15046 163.7
[M+HCOO]- 352.15140 183.1
[M+CH3COO]- 366.16705 202.8
[M+Na-2H]- 328.12787 176.9
[M]+ 307.15265 171.6
[M]- 307.15375 171.6
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.