CID 45091173

923595-95-3

Structural Information

Molecular Formula

C₉H₁₉NO₂

SMILES

COCCOC1CCC(CC1)N

InChI

InChI=1S/C9H19NO2/c1-11-6-7-12-9-4-2-8(10)3-5-9/h8-9H,2-7,10H2,1H3

InChIKey

YFUKJAYFLVIFPJ-UHFFFAOYSA-N

Compound name

4-(2-methoxyethoxy)cyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 78
Patents: 173.14159 Da
Monoisotopic Mass: 0.3
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]+	174.148866	139.7
[M+Na]+	196.130808	143.9
[M-H]-	172.134314	141.8
[M+NH4]+	191.175413	159.4
[M+K]+	212.104748	143.3
[M+H-H2O]+	156.138850	133.6
[M+HCOO]-	218.139791	160.7
[M+CH3COO]-	232.155441	181.8
[M+Na-2H]-	194.116256	143.4
[M]+	173.14104142	136.8
[M]-	173.14213858	136.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe