CID 9500

6-aminonicotinamide

Structural Information

Molecular Formula
C6H7N3O
SMILES
C1=CC(=NC=C1C(=O)N)N
InChI
InChI=1S/C6H7N3O/c7-5-2-1-4(3-9-5)6(8)10/h1-3H,(H2,7,9)(H2,8,10)
InChIKey
ZLWYEPMDOUQDBW-UHFFFAOYSA-N
Compound name
6-aminopyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

387
References

2620
Patents

137.05891 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.06619 125.6
[M+Na]+ 160.04813 136.4
[M+NH4]+ 155.09273 133.2
[M+K]+ 176.02207 132.0
[M-H]- 136.05163 127.5
[M+Na-2H]- 158.03358 132.0
[M]+ 137.05836 127.3
[M]- 137.05946 127.3
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