CID 84649663

2-(1-cyclopropyl-1h-1,2,3-triazol-4-yl)ethan-1-amine dihydrochloride

Structural Information

Molecular Formula
C7H12N4
SMILES
C1CC1N2C=C(N=N2)CCN
InChI
InChI=1S/C7H12N4/c8-4-3-6-5-11(10-9-6)7-1-2-7/h5,7H,1-4,8H2
InChIKey
KHDBXRADZIIFBK-UHFFFAOYSA-N
Compound name
2-(1-cyclopropyltriazol-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.1062 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.11348 133.7
[M+Na]+ 175.09542 145.8
[M+NH4]+ 170.14002 141.8
[M+K]+ 191.06936 143.5
[M-H]- 151.09892 141.9
[M+Na-2H]- 173.08087 142.3
[M]+ 152.10565 138.6
[M]- 152.10675 138.6
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.