CID 84021376

2551115-11-6

Structural Information

Molecular Formula
C8H14N4
SMILES
C1CC(CCC1N)N2C=CN=N2
InChI
InChI=1S/C8H14N4/c9-7-1-3-8(4-2-7)12-6-5-10-11-12/h5-8H,1-4,9H2
InChIKey
VAWCWWMADSCPDU-UHFFFAOYSA-N
Compound name
4-(triazol-1-yl)cyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

166.12184 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.129116 136.3
[M+Na]+ 189.111058 142.5
[M-H]- 165.114564 138.0
[M+NH4]+ 184.155663 153.7
[M+K]+ 205.084998 140.1
[M+H-H2O]+ 149.119100 127.2
[M+HCOO]- 211.120041 155.6
[M+CH3COO]- 225.135691 148.0
[M+Na-2H]- 187.096506 140.6
[M]+ 166.12129142 130.0
[M]- 166.12238858 130.0
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