CID 83872361

2060052-70-0

Structural Information

Molecular Formula

C₅H₁₁N₅

SMILES

CN(C)C1=NNC(=N1)CN

InChI

InChI=1S/C5H11N5/c1-10(2)5-7-4(3-6)8-9-5/h3,6H2,1-2H3,(H,7,8,9)

InChIKey

DOJPFFJADLTHPX-UHFFFAOYSA-N

Compound name

5-(aminomethyl)-N,N-dimethyl-1H-1,2,4-triazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 141.10144 Da
Monoisotopic Mass: -0.7
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]+	142.10872	128.1
[M+Na]+	164.09066	137.2
[M+NH4]+	159.13526	134.7
[M+K]+	180.06460	135.3
[M-H]-	140.09416	128.2
[M+Na-2H]-	162.07611	133.0
[M]+	141.10089	128.9
[M]-	141.10199	128.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.