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4-Methyl 4-(3-hydroxy-3-methylbutanyl)-2-cyclohexenol

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

4-Methyl 4-(3-hydroxy-3-methylbutanyl)-2-cyclohexenol
SpectraBase Compound ID EOMYpeo0u23
InChI InChI=1S/C12H22O2/c1-11(2,14)8-9-12(3)6-4-10(13)5-7-12/h4,6,10,13-14H,5,7-9H2,1-3H3
InChIKey UKVHEVCCFNATKS-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HGy7Ak90hRC
Name 4-Methyl 4-(3-hydroxy-3-methylbutanyl)-2-cyclohexenol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 198.161979946 u
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-11(2,14)8-9-12(3)6-4-10(13)5-7-12/h4,6,10,13-14H,5,7-9H2,1-3H3
InChIKey UKVHEVCCFNATKS-UHFFFAOYSA-N
Molecular Weight 198.306 g/mol
SMILES C1(C=CC(CC1)(CCC(C)(C)O)C)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.817518