CID 209146

1-(2-cyanoethyl)-1-isopropyl hydrazine

Structural Information

Molecular Formula

C₆H₁₃N₃

SMILES

CC(C)N(CCC#N)N

InChI

InChI=1S/C6H13N3/c1-6(2)9(8)5-3-4-7/h6H,3,5,8H2,1-2H3

InChIKey

ZHVKHIASMJZTAH-UHFFFAOYSA-N

Compound name

3-[amino(propan-2-yl)amino]propanenitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 127.11095 Da
Monoisotopic Mass: 0.0
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]+	128.11823	131.4
[M+Na]+	150.10017	139.4
[M+NH4]+	145.14477	135.7
[M+K]+	166.07411	132.0
[M-H]-	126.10367	125.0
[M+Na-2H]-	148.08562	132.7
[M]+	127.11040	129.5
[M]-	127.11150	129.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.