CID 125512751

6-chloro-2-cyclopropylpyrimidine-4-carboxamide

Structural Information

Molecular Formula
C8H8ClN3O
SMILES
C1CC1C2=NC(=CC(=N2)Cl)C(=O)N
InChI
InChI=1S/C8H8ClN3O/c9-6-3-5(7(10)13)11-8(12-6)4-1-2-4/h3-4H,1-2H2,(H2,10,13)
InChIKey
PFGLOEYJGSUXOY-UHFFFAOYSA-N
Compound name
6-chloro-2-cyclopropylpyrimidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.03558 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.04286 139.1
[M+Na]+ 220.02480 153.5
[M+NH4]+ 215.06940 147.5
[M+K]+ 235.99874 149.2
[M-H]- 196.02830 148.2
[M+Na-2H]- 218.01025 148.8
[M]+ 197.03503 145.0
[M]- 197.03613 145.0
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

No patent data available for this compound.