CID 24692814

2-(1h-1,2,4-triazol-1-yl)pyridine-4-carboximidamide hydrochloride

Structural Information

Molecular Formula
C8H8N6
SMILES
C1=CN=C(C=C1C(=N)N)N2C=NC=N2
InChI
InChI=1S/C8H8N6/c9-8(10)6-1-2-12-7(3-6)14-5-11-4-13-14/h1-5H,(H3,9,10)
InChIKey
BENYCRGHPAJJGW-UHFFFAOYSA-N
Compound name
2-(1,2,4-triazol-1-yl)pyridine-4-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.08104 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.08832 138.4
[M+Na]+ 211.07026 146.9
[M-H]- 187.07376 140.2
[M+NH4]+ 206.11486 153.3
[M+K]+ 227.04420 143.3
[M+H-H2O]+ 171.07830 128.6
[M+HCOO]- 233.07924 161.0
[M+CH3COO]- 247.09489 150.5
[M+Na-2H]- 209.05571 145.4
[M]+ 188.08049 135.0
[M]- 188.08159 135.0
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.