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(1S,2S,4R)-1-(2-hydroxypropan-2-yl)-4-methyl-2-propan-2-yloxy-1-cyclohexanol
SpectraBase Compound ID 9I9aH45NYB8
InChI InChI=1S/C13H26O3/c1-9(2)16-11-8-10(3)6-7-13(11,15)12(4,5)14/h9-11,14-15H,6-8H2,1-5H3/t10-,11+,13+/m1/s1
InChIKey GXOKYAZXWQXTMU-MDZLAQPJSA-N
Mol Weight 230.35 g/mol
Molecular Formula C13H26O3
Exact Mass 230.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RnjzPJyTQx
Name (1S,2S,4R)-1-(2-hydroxypropan-2-yl)-4-methyl-2-propan-2-yloxy-1-cyclohexanol
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Formula C13H26O3
InChI InChI=1S/C13H26O3/c1-9(2)16-11-8-10(3)6-7-13(11,15)12(4,5)14/h9-11,14-15H,6-8H2,1-5H3/t10-,11+,13+/m1/s1
InChIKey GXOKYAZXWQXTMU-MDZLAQPJSA-N
Molecular Weight 230.348 g/mol
SMILES OC([C@]1([C@@](OC(C)C)(C[C@@](CC1)(C)[H])[H])O)(C)C
SPLASH splash10-03dj-3900000000-e8c6de9348c07ed74a80
Source of Spectrum J-64-632-3
Synonyms (1S,2S,4R)-1-(2-hydroxypropan-2-yl)-4-methyl-2-propan-2-yloxycyclohexan-1-ol (1S,2S,4R)-4-methyl-1-(2-oxidanylpropan-2-yl)-2-propan-2-yloxy-cyclohexan-1-ol
Wiley ID 1529219