CID 117339

26946-68-9

Structural Information

Molecular Formula

C₁₁H₂₀O

SMILES

CC(=C)C1CCC(CC1)(C)OC

InChI

InChI=1S/C11H20O/c1-9(2)10-5-7-11(3,12-4)8-6-10/h10H,1,5-8H2,2-4H3

InChIKey

OLQOOKYEEAQGPU-UHFFFAOYSA-N

Compound name

1-methoxy-1-methyl-4-prop-1-en-2-ylcyclohexane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 168.15141 Da
Monoisotopic Mass: 3.1
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]+	169.15869	140.7
[M+Na]+	191.14063	151.4
[M+NH4]+	186.18523	151.0
[M+K]+	207.11457	143.1
[M-H]-	167.14413	142.7
[M+Na-2H]-	189.12608	146.7
[M]+	168.15086	142.9
[M]-	168.15196	142.9

Literature stripe

literature stripe

Patent stripe

patents stripe