CID 3050749

Guanidine, 2-cyano-1-(3-pyridyl)-

Structural Information

Molecular Formula
C7H7N5
SMILES
C1=CC(=CN=C1)N=C(N)NC#N
InChI
InChI=1S/C7H7N5/c8-5-11-7(9)12-6-2-1-3-10-4-6/h1-4H,(H3,9,11,12)
InChIKey
VBKOBCGEDSEGCI-UHFFFAOYSA-N
Compound name
1-cyano-2-pyridin-3-ylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

14
Patents

161.07014 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.07742 141.1
[M+Na]+ 184.05936 150.5
[M+NH4]+ 179.10396 145.0
[M+K]+ 200.03330 141.9
[M-H]- 160.06286 136.4
[M+Na-2H]- 182.04481 145.0
[M]+ 161.06959 139.9
[M]- 161.07069 139.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe