CID 24702034

2-(1h-pyrazol-1-yl)ethanimidamide hydrochloride

Structural Information

Molecular Formula
C5H8N4
SMILES
C1=CN(N=C1)CC(=N)N
InChI
InChI=1S/C5H8N4/c6-5(7)4-9-3-1-2-8-9/h1-3H,4H2,(H3,6,7)
InChIKey
SCSJUIZPWDBNFV-UHFFFAOYSA-N
Compound name
2-pyrazol-1-ylethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

124.0749 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.082176 123.5
[M+Na]+ 147.064118 130.8
[M-H]- 123.067624 124.2
[M+NH4]+ 142.108723 143.7
[M+K]+ 163.038058 129.4
[M+H-H2O]+ 107.072160 116.0
[M+HCOO]- 169.073101 148.1
[M+CH3COO]- 183.088751 173.7
[M+Na-2H]- 145.049566 130.0
[M]+ 124.07435142 119.8
[M]- 124.07544858 119.8
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

patents stripe