CID 75355385

Dimethyl-1h-1,2,3-triazol-4-amine hydrochloride

Structural Information

Molecular Formula
C4H8N4
SMILES
CC1=C(N=NN1C)N
InChI
InChI=1S/C4H8N4/c1-3-4(5)6-7-8(3)2/h5H2,1-2H3
InChIKey
BTCAMNSYQXGQEQ-UHFFFAOYSA-N
Compound name
1,5-dimethyltriazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

112.0749 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.08218 120.6
[M+Na]+ 135.06412 131.2
[M-H]- 111.06762 120.7
[M+NH4]+ 130.10872 141.2
[M+K]+ 151.03806 130.1
[M+H-H2O]+ 95.072160 113.5
[M+HCOO]- 157.07310 144.0
[M+CH3COO]- 171.08875 171.0
[M+Na-2H]- 133.04957 126.9
[M]+ 112.07435 120.0
[M]- 112.07545 120.0
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

patents stripe