CID 421389

Cyclohexyl-ethyl-dimethylazanium;chloride

Structural Information

Molecular Formula

C₁₀H₂₂N

SMILES

CC[N+](C)(C)C1CCCCC1

InChI

InChI=1S/C10H22N/c1-4-11(2,3)10-8-6-5-7-9-10/h10H,4-9H2,1-3H3/q+1

InChIKey

XURMURYJWMFWER-UHFFFAOYSA-N

Compound name

cyclohexyl-ethyl-dimethylazanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 257
Patents: 156.17523 Da
Monoisotopic Mass: 2.5
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]+	157.18251	134.9
[M+Na]+	179.16445	138.7
[M-H]-	155.16795	139.1
[M+NH4]+	174.20905	156.2
[M+K]+	195.13839	133.1
[M+H-H2O]+	139.17249	132.4
[M+HCOO]-	201.17343	155.4
[M+CH3COO]-	215.18908	177.0
[M+Na-2H]-	177.14990	143.4
[M]+	156.17468	129.9
[M]-	156.17578	129.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe