CID 19875354

1-cyclohexylbutan-1-amine

Structural Information

Molecular Formula

C₁₀H₂₁N

SMILES

CCCC(C1CCCCC1)N

InChI

InChI=1S/C10H21N/c1-2-6-10(11)9-7-4-3-5-8-9/h9-10H,2-8,11H2,1H3

InChIKey

XBBUVRNYVXYZEO-UHFFFAOYSA-N

Compound name

1-cyclohexylbutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 155.1674 Da
Monoisotopic Mass: 3.0
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]+	156.17468	138.5
[M+Na]+	178.15662	147.6
[M+NH4]+	173.20122	147.6
[M+K]+	194.13056	141.2
[M-H]-	154.16012	141.2
[M+Na-2H]-	176.14207	143.1
[M]+	155.16685	140.3
[M]-	155.16795	140.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe