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rel-(2S,4R,6S)-2-Cyclohexyl-4,6-dimethyl-1,3-dioxane

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rel-(2S,4R,6S)-2-Cyclohexyl-4,6-dimethyl-1,3-dioxane
SpectraBase Compound ID 3lCYi8wpRWY
InChI InChI=1S/C12H22O2/c1-9-8-10(2)14-12(13-9)11-6-4-3-5-7-11/h9-12H,3-8H2,1-2H3/t9-,10+,12-
InChIKey IBMSLORVEFLRTQ-PEGIJTEDSA-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 2SiK77lKu8
Name rel-(2S,4R,6S)-2-Cyclohexyl-4,6-dimethyl-1,3-dioxane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-9-8-10(2)14-12(13-9)11-6-4-3-5-7-11/h9-12H,3-8H2,1-2H3/t9-,10+,12-
InChIKey IBMSLORVEFLRTQ-PEGIJTEDSA-N
Molecular Weight 198.306 g/mol
SMILES [C@]1(O[C@@](C)(C[C@](O1)(C)[H])[H])(C1CCCCC1)[H]
SPLASH splash10-014m-9200000000-bd72f44b2844a2e0f027
Source of Spectrum C-113-8104-1
Synonyms (4R,6S)-2-cyclohexyl-4,6-dimethyl-1,3-dioxane
Wiley ID 1195916