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

*Links on SpectraBase are not permalinks.

Cyclohexanol, 4-(2-hydroxy-1-methylethylidene)-1-methyl-, 1-acetate

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

Cyclohexanol, 4-(2-hydroxy-1-methylethylidene)-1-methyl-, 1-acetate
SpectraBase Compound ID KPVWSLL0IEB
InChI InChI=1S/C12H20O3/c1-9(8-13)11-4-6-12(3,7-5-11)15-10(2)14/h13H,4-8H2,1-3H3/b11-9-
InChIKey UAAVBIOYAMYMRZ-LUAWRHEFSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 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 Lf0mYZj8JUd
Name Cyclohexanol, 4-(2-hydroxy-1-methylethylidene)-1-methyl-, 1-acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.141244501 u
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-9(8-13)11-4-6-12(3,7-5-11)15-10(2)14/h13H,4-8H2,1-3H3/b11-9-
InChIKey UAAVBIOYAMYMRZ-LUAWRHEFSA-N
Molecular Weight 212.289 g/mol
SMILES C1(=C(CO)C)CCC(CC1)(OC(=O)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945313