CID 10953821

N-(3-cyanopyridin-2-yl)acetamide

Structural Information

Molecular Formula
C8H7N3O
SMILES
CC(=O)NC1=C(C=CC=N1)C#N
InChI
InChI=1S/C8H7N3O/c1-6(12)11-8-7(5-9)3-2-4-10-8/h2-4H,1H3,(H,10,11,12)
InChIKey
FZQJJMNVXNHAMM-UHFFFAOYSA-N
Compound name
N-(3-cyanopyridin-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

161.05891 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.06619 136.5
[M+Na]+ 184.04813 147.9
[M+NH4]+ 179.09273 140.7
[M+K]+ 200.02207 139.2
[M-H]- 160.05163 130.8
[M+Na-2H]- 182.03358 140.5
[M]+ 161.05836 135.5
[M]- 161.05946 135.5
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