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

5
Patents

257.11642 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.12370 158.4
[M+Na]+ 280.10564 167.2
[M-H]- 256.10914 162.2
[M+NH4]+ 275.15024 173.9
[M+K]+ 296.07958 163.0
[M+H-H2O]+ 240.11368 149.2
[M+HCOO]- 302.11462 176.2
[M+CH3COO]- 316.13027 169.9
[M+Na-2H]- 278.09109 161.2
[M]+ 257.11587 157.6
[M]- 257.11697 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