CID 121552552

4-methoxypyrimidine-2-carboxamide

Structural Information

Molecular Formula
C6H7N3O2
SMILES
COC1=NC(=NC=C1)C(=O)N
InChI
InChI=1S/C6H7N3O2/c1-11-4-2-3-8-6(9-4)5(7)10/h2-3H,1H3,(H2,7,10)
InChIKey
NMHWZLPJTBVIIK-UHFFFAOYSA-N
Compound name
4-methoxypyrimidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

153.05383 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.061106 128.8
[M+Na]+ 176.043048 137.6
[M-H]- 152.046554 129.8
[M+NH4]+ 171.087653 146.7
[M+K]+ 192.016988 136.6
[M+H-H2O]+ 136.051090 121.6
[M+HCOO]- 198.052031 151.9
[M+CH3COO]- 212.067681 177.0
[M+Na-2H]- 174.028496 136.1
[M]+ 153.05328142 128.8
[M]- 153.05437858 128.8
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