CID 115832

4h-pyrido[1,2-a]pyrimidine-3-carboxamide, 1,6,7,8-tetrahydro-1,6-dimethyl-4-oxo-

Structural Information

Molecular Formula
C11H15N3O2
SMILES
CC1CCC=C2N1C(=O)C(=CN2C)C(=O)N
InChI
InChI=1S/C11H15N3O2/c1-7-4-3-5-9-13(2)6-8(10(12)15)11(16)14(7)9/h5-7H,3-4H2,1-2H3,(H2,12,15)
InChIKey
OVTCEDCBXAYKQZ-UHFFFAOYSA-N
Compound name
1,6-dimethyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

7
Patents

221.11642 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.12370 149.9
[M+Na]+ 244.10564 157.9
[M-H]- 220.10914 151.2
[M+NH4]+ 239.15024 166.5
[M+K]+ 260.07958 155.0
[M+H-H2O]+ 204.11368 142.5
[M+HCOO]- 266.11462 166.8
[M+CH3COO]- 280.13027 193.6
[M+Na-2H]- 242.09109 152.6
[M]+ 221.11587 146.7
[M]- 221.11697 146.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe