CID 79501292

2-(4-chlorophenyl)-2h-1,2,3-triazol-4-amine hydrochloride

Structural Information

Molecular Formula
C8H7ClN4
SMILES
C1=CC(=CC=C1N2N=CC(=N2)N)Cl
InChI
InChI=1S/C8H7ClN4/c9-6-1-3-7(4-2-6)13-11-5-8(10)12-13/h1-5H,(H2,10,12)
InChIKey
OOGUFZAHVNDIRL-UHFFFAOYSA-N
Compound name
2-(4-chlorophenyl)triazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.03592 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.04320 137.4
[M+Na]+ 217.02514 151.8
[M+NH4]+ 212.06974 145.8
[M+K]+ 232.99908 146.8
[M-H]- 193.02864 140.3
[M+Na-2H]- 215.01059 146.3
[M]+ 194.03537 140.5
[M]- 194.03647 140.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.