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(1R,6S)-Ethyl 2,2,6-Trimethylcyclohexylcarboxylate
SpectraBase Compound ID 6W94wlvliNv
InChI InChI=1S/C12H22O2/c1-5-14-11(13)10-9(2)7-6-8-12(10,3)4/h9-10H,5-8H2,1-4H3/t9-,10-/m0/s1
InChIKey TUEUDXZEBRMJEV-UWVGGRQHSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GwoYh7rcX7S
Name (1R,6S)-Ethyl 2,2,6-Trimethylcyclohexylcarboxylate
Classification Carboxylic acid esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 198.161979946 u
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-5-14-11(13)10-9(2)7-6-8-12(10,3)4/h9-10H,5-8H2,1-4H3/t9-,10-/m0/s1
InChIKey TUEUDXZEBRMJEV-UWVGGRQHSA-N
Molecular Weight 198.306 g/mol
Number of Peaks 12
SMILES C1CC[C@](C)([C@@](C(=O)OCC)(C1(C)C)[H])[H]
SPLASH splash10-0aor-9500000000-9b9a9673660d60b30263
Source of Spectrum FF-19-125-(1R,6S)_24 (DOI: 10.1002/ffj.1280)
Synonyms (1R, 6S)-Ethyl 2,2,6-trimethylcyclohexylcarboxylate (1R,6S)-2,2,6-trimethyl-1-cyclohexanecarboxylic acid ethyl ester Ethyl (1R,6S)-2,2,6-trimethylcyclohexanecarboxylate Ethyl (1R,6S)-2,2,6-trimethylcyclohexane-1-carboxylate (1R,6S)-ethyl 2,2,6-trimethylcyclohexanecarboxylate
Wiley ID 1775341