CID 87511349

1-ethynyl-n,n-dimethylcyclohexan-1-amine

Structural Information

Molecular Formula

C₁₀H₁₇N

SMILES

CN(C)C1(CCCCC1)C#C

InChI

InChI=1S/C10H17N/c1-4-10(11(2)3)8-6-5-7-9-10/h1H,5-9H2,2-3H3

InChIKey

LXRBKIADSMSQLH-UHFFFAOYSA-N

Compound name

1-ethynyl-N,N-dimethylcyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 151.1361 Da
Monoisotopic Mass: 2.0
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]+	152.14338	136.3
[M+Na]+	174.12532	146.6
[M+NH4]+	169.16992	143.4
[M+K]+	190.09926	135.6
[M-H]-	150.12882	131.4
[M+Na-2H]-	172.11077	140.5
[M]+	151.13555	135.7
[M]-	151.13665	135.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe