CID 54595312

5-cyano-n,n-dimethylpyridine-2-carboxamide

Structural Information

Molecular Formula
C9H9N3O
SMILES
CN(C)C(=O)C1=NC=C(C=C1)C#N
InChI
InChI=1S/C9H9N3O/c1-12(2)9(13)8-4-3-7(5-10)6-11-8/h3-4,6H,1-2H3
InChIKey
AKSXADYDAQVBMV-UHFFFAOYSA-N
Compound name
5-cyano-N,N-dimethylpyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.07455 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.08183 139.7
[M+Na]+ 198.06377 151.1
[M+NH4]+ 193.10837 144.0
[M+K]+ 214.03771 142.7
[M-H]- 174.06727 134.3
[M+Na-2H]- 196.04922 143.7
[M]+ 175.07400 138.8
[M]- 175.07510 138.8
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

No patent data available for this compound.