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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.