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1-Hydroxy-3,3,5-trimethylcyclohexaneacetic acid

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

1-Hydroxy-3,3,5-trimethylcyclohexaneacetic acid
SpectraBase Compound ID OZP575aC4J
InChI InChI=1S/C11H20O3/c1-8-4-10(2,3)7-11(14,5-8)6-9(12)13/h8,14H,4-7H2,1-3H3,(H,12,13)
InChIKey PZZGCKVTCHFKLS-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 6ZgLYMCU75f
Name 1-Hydroxy-3,3,5-trimethylcyclohexaneacetic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.141244501 u
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-8-4-10(2,3)7-11(14,5-8)6-9(12)13/h8,14H,4-7H2,1-3H3,(H,12,13)
InChIKey PZZGCKVTCHFKLS-UHFFFAOYSA-N
Molecular Weight 200.278 g/mol
SMILES OC(CC1(CC(CC(C1)(C)C)C)O)=O
Spectrum/Structure Validation Score (Raman) 0.97329