CID 154734799

Cyclohexanol, 5-ethylidene-2-propoxy-

Structural Information

Molecular Formula

C₁₁H₂₀O₂

SMILES

CCCOC1CCC(=CC)CC1O

InChI

InChI=1S/C11H20O2/c1-3-7-13-11-6-5-9(4-2)8-10(11)12/h4,10-12H,3,5-8H2,1-2H3

InChIKey

GIZPOCVFOCTZBV-UHFFFAOYSA-N

Compound name

5-ethylidene-2-propoxycyclohexan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 184.14633 Da
Monoisotopic Mass: 1.8
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]+	185.15361	143.4
[M+Na]+	207.13555	153.6
[M+NH4]+	202.18015	151.4
[M+K]+	223.10949	147.2
[M-H]-	183.13905	144.6
[M+Na-2H]-	205.12100	146.9
[M]+	184.14578	144.9
[M]-	184.14688	144.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe