CID 123363

16607-80-0

Structural Information

Molecular Formula

C₉H₁₉N

SMILES

CN(C)CC1CCCCC1

InChI

InChI=1S/C9H19N/c1-10(2)8-9-6-4-3-5-7-9/h9H,3-8H2,1-2H3

InChIKey

MNKFLCYZIHOFRQ-UHFFFAOYSA-N

Compound name

1-cyclohexyl-N,N-dimethylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 348
Patents: 141.15175 Da
Monoisotopic Mass: 2.6
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	133.5
[M+Na]+	164.140968	137.0
[M-H]-	140.144474	137.4
[M+NH4]+	159.185573	155.2
[M+K]+	180.114908	137.3
[M+H-H2O]+	124.149010	127.5
[M+HCOO]-	186.149951	155.2
[M+CH3COO]-	200.165601	180.9
[M+Na-2H]-	162.126416	138.2
[M]+	141.15120142	129.6
[M]-	141.15229858	129.6

Literature stripe

literature stripe

Patent stripe

patents stripe