CID 10866620

2,2-dimethoxycyclohexan-1-amine

Structural Information

Molecular Formula

C₈H₁₇NO₂

SMILES

COC1(CCCCC1N)OC

InChI

InChI=1S/C8H17NO2/c1-10-8(11-2)6-4-3-5-7(8)9/h7H,3-6,9H2,1-2H3

InChIKey

MCOLOLWDFKRJSF-UHFFFAOYSA-N

Compound name

2,2-dimethoxycyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 159.12593 Da
Monoisotopic Mass: 0.2
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]+	160.13321	134.7
[M+Na]+	182.11515	144.1
[M+NH4]+	177.15975	144.6
[M+K]+	198.08909	137.1
[M-H]-	158.11865	136.7
[M+Na-2H]-	180.10060	140.7
[M]+	159.12538	136.5
[M]-	159.12648	136.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe