CID 17024596

2-(1h-pyrazol-1-yl)acetohydrazide

Structural Information

Molecular Formula
C5H8N4O
SMILES
C1=CN(N=C1)CC(=O)NN
InChI
InChI=1S/C5H8N4O/c6-8-5(10)4-9-3-1-2-7-9/h1-3H,4,6H2,(H,8,10)
InChIKey
NJBHEQPBKPVVCC-UHFFFAOYSA-N
Compound name
2-pyrazol-1-ylacetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

140.06981 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.077086 126.4
[M+Na]+ 163.059028 133.6
[M-H]- 139.062534 127.1
[M+NH4]+ 158.103633 146.0
[M+K]+ 179.032968 132.8
[M+H-H2O]+ 123.067070 118.7
[M+HCOO]- 185.068011 151.3
[M+CH3COO]- 199.083661 175.1
[M+Na-2H]- 161.044476 132.9
[M]+ 140.06926142 124.0
[M]- 140.07035858 124.0
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