CID 135583287

5-chloro-n,n-dimethyl-1h-1,2,3-triazole-4-carboximidamide monohydrochloride

Structural Information

Molecular Formula
C5H8ClN5
SMILES
CN(C)C(=N)C1=NNN=C1Cl
InChI
InChI=1S/C5H8ClN5/c1-11(2)5(7)3-4(6)9-10-8-3/h7H,1-2H3,(H,8,9,10)
InChIKey
UAXCBAPUNBZNHR-UHFFFAOYSA-N
Compound name
5-chloro-N,N-dimethyl-2H-triazole-4-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.04683 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.05411 135.5
[M+Na]+ 196.03605 144.1
[M-H]- 172.03955 135.6
[M+NH4]+ 191.08065 153.7
[M+K]+ 212.00999 141.5
[M+H-H2O]+ 156.04409 127.8
[M+HCOO]- 218.04503 153.6
[M+CH3COO]- 232.06068 182.4
[M+Na-2H]- 194.02150 140.3
[M]+ 173.04628 134.6
[M]- 173.04738 134.6
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.