CID 2757984

496057-24-0

Structural Information

Molecular Formula
C6H10N4
SMILES
C1CC(C1)C2=NC(=NN2)N
InChI
InChI=1S/C6H10N4/c7-6-8-5(9-10-6)4-2-1-3-4/h4H,1-3H2,(H3,7,8,9,10)
InChIKey
FZFDWTMNAIGNKZ-UHFFFAOYSA-N
Compound name
5-cyclobutyl-1H-1,2,4-triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

138.09055 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.09783 127.4
[M+Na]+ 161.07977 133.8
[M-H]- 137.08327 128.3
[M+NH4]+ 156.12437 139.1
[M+K]+ 177.05371 134.3
[M+H-H2O]+ 121.08781 114.1
[M+HCOO]- 183.08875 146.8
[M+CH3COO]- 197.10440 175.1
[M+Na-2H]- 159.06522 132.2
[M]+ 138.09000 131.0
[M]- 138.09110 131.0
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