CID 82502370

1-(aminomethyl)cyclobutane-1-carbonitrile

Structural Information

Molecular Formula

C₆H₁₀N₂

SMILES

C1CC(C1)(CN)C#N

InChI

InChI=1S/C6H10N2/c7-4-6(5-8)2-1-3-6/h1-4,7H2

InChIKey

UEBWHAAQVVWZAU-UHFFFAOYSA-N

Compound name

1-(aminomethyl)cyclobutane-1-carbonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 56
Patents: 110.0844 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]+	111.09168	126.3
[M+Na]+	133.07362	131.9
[M+NH4]+	128.11822	129.4
[M+K]+	149.04756	123.8
[M-H]-	109.07712	118.9
[M+Na-2H]-	131.05907	128.3
[M]+	110.08385	123.2
[M]-	110.08495	123.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe