CID 11112

Nicotinic acid hydrazide

Structural Information

Molecular Formula
C6H7N3O
SMILES
C1=CC(=CN=C1)C(=O)NN
InChI
InChI=1S/C6H7N3O/c7-9-6(10)5-2-1-3-8-4-5/h1-4H,7H2,(H,9,10)
InChIKey
KFUSANSHCADHNJ-UHFFFAOYSA-N
Compound name
pyridine-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

83
References

2257
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 125.9
[M+Na]+ 160.04813 136.6
[M+NH4]+ 155.09273 133.6
[M+K]+ 176.02207 131.7
[M-H]- 136.05163 127.8
[M+Na-2H]- 158.03358 132.9
[M]+ 137.05836 127.6
[M]- 137.05946 127.6
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