CID 3079276

4h-pyrido(1,2-a)pyrimidine-3-carboxamide, n-(1,1-dimethylethyl)-6-methyl-4-oxo-

Structural Information

Molecular Formula
C14H17N3O2
SMILES
CC1=CC=CC2=NC=C(C(=O)N12)C(=O)NC(C)(C)C
InChI
InChI=1S/C14H17N3O2/c1-9-6-5-7-11-15-8-10(13(19)17(9)11)12(18)16-14(2,3)4/h5-8H,1-4H3,(H,16,18)
InChIKey
TWOQZTKIJXLQEP-UHFFFAOYSA-N
Compound name
N-tert-butyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

259.13208 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.13936 160.3
[M+Na]+ 282.12130 169.7
[M-H]- 258.12480 162.9
[M+NH4]+ 277.16590 175.9
[M+K]+ 298.09524 166.3
[M+H-H2O]+ 242.12934 152.8
[M+HCOO]- 304.13028 179.7
[M+CH3COO]- 318.14593 200.0
[M+Na-2H]- 280.10675 167.1
[M]+ 259.13153 162.5
[M]- 259.13263 162.5
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