CID 79396

5400-88-4

Structural Information

Molecular Formula

C₁₀H₂₁N

SMILES

CC(C)(C)C1CCC(CC1)N

InChI

InChI=1S/C10H21N/c1-10(2,3)8-4-6-9(11)7-5-8/h8-9H,4-7,11H2,1-3H3

InChIKey

BGNLXETYTAAURD-UHFFFAOYSA-N

Compound name

4-tert-butylcyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1309
Patents: 155.1674 Da
Monoisotopic Mass: 2.8
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	137.7
[M+Na]+	178.15662	147.2
[M+NH4]+	173.20122	146.8
[M+K]+	194.13056	141.5
[M-H]-	154.16012	140.1
[M+Na-2H]-	176.14207	142.4
[M]+	155.16685	139.6
[M]-	155.16795	139.6

Literature stripe

literature stripe

Patent stripe

patents stripe