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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	125.08218	126.1
[M+Na]+	147.06412	138.5
[M+NH4]+	142.10872	134.4
[M+K]+	163.03806	136.6
[M-H]-	123.06762	134.4
[M+Na-2H]-	145.04957	135.1
[M]+	124.07435	131.0
[M]-	124.07545	131.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.