CID 84647813

1785627-17-9

Structural Information

Molecular Formula
C5H8N4
SMILES
C1CC1N2C=NC(=N2)N
InChI
InChI=1S/C5H8N4/c6-5-7-3-9(8-5)4-1-2-4/h3-4H,1-2H2,(H2,6,8)
InChIKey
JBCOUGQDMIWSTQ-UHFFFAOYSA-N
Compound name
1-cyclopropyl-1,2,4-triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

124.0749 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.082176 130.1
[M+Na]+ 147.064118 141.3
[M-H]- 123.067624 133.7
[M+NH4]+ 142.108723 144.9
[M+K]+ 163.038058 137.7
[M+H-H2O]+ 107.072160 121.9
[M+HCOO]- 169.073101 153.6
[M+CH3COO]- 183.088751 143.4
[M+Na-2H]- 145.049566 136.2
[M]+ 124.07435142 130.4
[M]- 124.07544858 130.4
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.