CID 470389

2-acetylaminomethylisonicotinic acid hydrazide

Structural Information

Molecular Formula
C9H12N4O2
SMILES
CC(=O)NCC1=NC=CC(=C1)C(=O)NN
InChI
InChI=1S/C9H12N4O2/c1-6(14)12-5-8-4-7(2-3-11-8)9(15)13-10/h2-4H,5,10H2,1H3,(H,12,14)(H,13,15)
InChIKey
MPVLSKFIQLPESR-UHFFFAOYSA-N
Compound name
N-[[4-(hydrazinecarbonyl)pyridin-2-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

3
Patents

208.09602 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.10330 145.2
[M+Na]+ 231.08524 151.0
[M-H]- 207.08874 147.2
[M+NH4]+ 226.12984 161.4
[M+K]+ 247.05918 149.4
[M+H-H2O]+ 191.09328 137.4
[M+HCOO]- 253.09422 169.8
[M+CH3COO]- 267.10987 192.4
[M+Na-2H]- 229.07069 150.2
[M]+ 208.09547 142.7
[M]- 208.09657 142.7
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