CID 43140234

1-methyl-1h-pyrazole-4-carboximidamide hydrochloride

Structural Information

Molecular Formula
C5H8N4
SMILES
CN1C=C(C=N1)C(=N)N
InChI
InChI=1S/C5H8N4/c1-9-3-4(2-8-9)5(6)7/h2-3H,1H3,(H3,6,7)
InChIKey
LSTVYCDNVXCWSS-UHFFFAOYSA-N
Compound name
1-methylpyrazole-4-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

124.0749 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.082176 123.8
[M+Na]+ 147.064118 132.1
[M-H]- 123.067624 124.9
[M+NH4]+ 142.108723 144.4
[M+K]+ 163.038058 130.6
[M+H-H2O]+ 107.072160 116.6
[M+HCOO]- 169.073101 148.4
[M+CH3COO]- 183.088751 174.8
[M+Na-2H]- 145.049566 129.5
[M]+ 124.07435142 120.5
[M]- 124.07544858 120.5
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