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3-tert-Butyl-1,4-dimethyl-1,3-cyclohexanediol
SpectraBase Compound ID EC9afJdg83z
InChI InChI=1S/C11H22O2/c1-8-6-10(5,12)7-11(8,13)9(2,3)4/h8,12-13H,6-7H2,1-5H3/t8-,10+,11+/m0/s1
InChIKey PXVKBVBUSPGYSE-JMJZKYOTSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CD4BlevIx6w
Name 3-tert-Butyl-1,4-dimethyl-1,3-cyclohexanediol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-8-6-10(5,12)7-11(8,13)9(2,3)4/h8,12-13H,6-7H2,1-5H3/t8-,10+,11+/m0/s1
InChIKey PXVKBVBUSPGYSE-JMJZKYOTSA-N
Molecular Weight 186.295 g/mol
SMILES O[C@]1(C[C@@]([C@](C1)(C)[H])(C(C)(C)C)O)C
SPLASH splash10-052f-9100000000-2072859af539be337d09
Source of Spectrum J-62-2942-15
Synonyms (1R,3R,4S)-3-tert-Butyl-1,4-dimethyl-cyclopentane-1,3-diol
Wiley ID 1183183