CID 3079297

Pyrrolidine, 1-((6-methyl-4-oxo-4h-pyrido(1,2-a)pyrimidin-3-yl)carbonyl)-

Structural Information

Molecular Formula
C14H15N3O2
SMILES
CC1=CC=CC2=NC=C(C(=O)N12)C(=O)N3CCCC3
InChI
InChI=1S/C14H15N3O2/c1-10-5-4-6-12-15-9-11(14(19)17(10)12)13(18)16-7-2-3-8-16/h4-6,9H,2-3,7-8H2,1H3
InChIKey
NRNDGOPSXXHRLY-UHFFFAOYSA-N
Compound name
6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

257.11642 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.123696 158.4
[M+Na]+ 280.105638 167.2
[M-H]- 256.109144 162.2
[M+NH4]+ 275.150243 173.9
[M+K]+ 296.079578 163.0
[M+H-H2O]+ 240.113680 149.2
[M+HCOO]- 302.114621 176.2
[M+CH3COO]- 316.130271 169.9
[M+Na-2H]- 278.091086 161.2
[M]+ 257.11587142 157.6
[M]- 257.11696858 157.6
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

patents stripe