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]+ 308.160476 174.2
[M+Na]+ 330.142418 178.8
[M-H]- 306.145924 176.3
[M+NH4]+ 325.187023 181.9
[M+K]+ 346.116358 177.5
[M+H-H2O]+ 290.150460 163.7
[M+HCOO]- 352.151401 183.1
[M+CH3COO]- 366.167051 202.8
[M+Na-2H]- 328.127866 176.9
[M]+ 307.15265142 171.6
[M]- 307.15374858 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.