CID 106834

(1-methoxyethyl)cyclohexane

Structural Information

Molecular Formula

C₉H₁₈O

SMILES

CC(C1CCCCC1)OC

InChI

InChI=1S/C9H18O/c1-8(10-2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3

InChIKey

ZNPFXBUKHUJVKH-UHFFFAOYSA-N

Compound name

1-methoxyethylcyclohexane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 290
Patents: 142.13577 Da
Monoisotopic Mass: 2.9
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]+	143.14305	133.0
[M+Na]+	165.12499	143.4
[M+NH4]+	160.16959	142.4
[M+K]+	181.09893	137.2
[M-H]-	141.12849	135.2
[M+Na-2H]-	163.11044	138.2
[M]+	142.13522	135.0
[M]-	142.13632	135.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe