For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Methyl 3-(4-cyclohexen-1-yl)-3-methoxypropanoate

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Methyl 3-(4-cyclohexen-1-yl)-3-methoxypropanoate
SpectraBase Compound ID 38t6BWUcvK
InChI InChI=1S/C11H18O3/c1-13-10(8-11(12)14-2)9-6-4-3-5-7-9/h3-4,9-10H,5-8H2,1-2H3
InChIKey FJDLLYOGQUWBQV-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4KOfTmF5ZXH
Name Methyl 3-(4-cyclohexen-1-yl)-3-methoxypropanoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 198.125594437 u
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-13-10(8-11(12)14-2)9-6-4-3-5-7-9/h3-4,9-10H,5-8H2,1-2H3
InChIKey FJDLLYOGQUWBQV-UHFFFAOYSA-N
Molecular Weight 198.262 g/mol
SMILES C(C(=O)OC)C(C1CC=CCC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953135