CID 3070292

2,2-dimethyl-4-(2-hydroxy-3-(1-pyrrolidinyl)propyl)-2h-pyrido(3,2-b)-1,4-oxazin-3(4h)-one

Structural Information

Molecular Formula
C16H23N3O3
SMILES
CC1(C(=O)N(C2=C(O1)C=CC=N2)CC(CN3CCCC3)O)C
InChI
InChI=1S/C16H23N3O3/c1-16(2)15(21)19(14-13(22-16)6-5-7-17-14)11-12(20)10-18-8-3-4-9-18/h5-7,12,20H,3-4,8-11H2,1-2H3
InChIKey
OULBZCCFXMGBRH-UHFFFAOYSA-N
Compound name
4-(2-hydroxy-3-pyrrolidin-1-ylpropyl)-2,2-dimethylpyrido[3,2-b][1,4]oxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.17395 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.18123 173.4
[M+Na]+ 328.16317 183.8
[M+NH4]+ 323.20777 180.8
[M+K]+ 344.13711 178.9
[M-H]- 304.16667 175.3
[M+Na-2H]- 326.14862 176.9
[M]+ 305.17340 175.3
[M]- 305.17450 175.3
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.