CID 135741956

1h-pyrazole-3-carboximidamide hydrochloride

Structural Information

Molecular Formula
C4H6N4
SMILES
C1=C(NN=C1)C(=N)N
InChI
InChI=1S/C4H6N4/c5-4(6)3-1-2-7-8-3/h1-2H,(H3,5,6)(H,7,8)
InChIKey
WBNTUGPRADFXAL-UHFFFAOYSA-N
Compound name
1H-pyrazole-5-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

959
Patents

110.05925 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.06653 119.6
[M+Na]+ 133.04847 126.9
[M-H]- 109.05197 119.1
[M+NH4]+ 128.09307 139.6
[M+K]+ 149.02241 124.8
[M+H-H2O]+ 93.056510 112.5
[M+HCOO]- 155.05745 143.0
[M+CH3COO]- 169.07310 168.1
[M+Na-2H]- 131.03392 126.1
[M]+ 110.05870 113.6
[M]- 110.05980 113.6
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