CID 13630819

2-cyclohexylpropan-1-amine hydrochloride

Structural Information

Molecular Formula

C₉H₁₉N

SMILES

CC(CN)C1CCCCC1

InChI

InChI=1S/C9H19N/c1-8(7-10)9-5-3-2-4-6-9/h8-9H,2-7,10H2,1H3

InChIKey

CDIYOXVOAKRWQT-UHFFFAOYSA-N

Compound name

2-cyclohexylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 150
Patents: 141.15175 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]+	142.159026	134.7
[M+Na]+	164.140968	137.8
[M-H]-	140.144474	136.6
[M+NH4]+	159.185573	155.4
[M+K]+	180.114908	136.8
[M+H-H2O]+	124.149010	129.0
[M+HCOO]-	186.149951	154.2
[M+CH3COO]-	200.165601	177.4
[M+Na-2H]-	162.126416	137.8
[M]+	141.15120142	127.8
[M]-	141.15229858	127.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe