CID 28064785

959240-74-5

Structural Information

Molecular Formula
C7H8ClN3O
SMILES
CN(C)C(=O)C1=CN=CC(=N1)Cl
InChI
InChI=1S/C7H8ClN3O/c1-11(2)7(12)5-3-9-4-6(8)10-5/h3-4H,1-2H3
InChIKey
FAJPFOLFEIYMJX-UHFFFAOYSA-N
Compound name
6-chloro-N,N-dimethylpyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

185.03558 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.04286 134.9
[M+Na]+ 208.02480 144.2
[M-H]- 184.02830 137.5
[M+NH4]+ 203.06940 153.4
[M+K]+ 223.99874 142.3
[M+H-H2O]+ 168.03284 128.0
[M+HCOO]- 230.03378 153.9
[M+CH3COO]- 244.04943 185.2
[M+Na-2H]- 206.01025 141.6
[M]+ 185.03503 137.9
[M]- 185.03613 137.9
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