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Cyclohexanol, 2-bromo-3-methoxy-3,5,5-trimethyl-, (1.alpha.,2.alpha.,3.beta.)-(.+-.)-
SpectraBase Compound ID jhbGcKiZ5F
InChI InChI=1S/C10H19BrO2/c1-9(2)5-7(12)8(11)10(3,6-9)13-4/h7-8,12H,5-6H2,1-4H3/t7-,8-,10+/m0/s1
InChIKey ZOUAVEICEQFQSX-OYNCUSHFSA-N
Mol Weight 251.16 g/mol
Molecular Formula C10H19BrO2
Exact Mass 250.056843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K2hmOdVmxHI
Name Cyclohexanol, 2-bromo-3-methoxy-3,5,5-trimethyl-, (1.alpha.,2.alpha.,3.beta.)-(.+-.)-
CAS Registry Number 131287-11-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H19BrO2
InChI InChI=1S/C10H19BrO2/c1-9(2)5-7(12)8(11)10(3,6-9)13-4/h7-8,12H,5-6H2,1-4H3/t7-,8-,10+/m0/s1
InChIKey ZOUAVEICEQFQSX-OYNCUSHFSA-N
Molecular Weight 251.164 g/mol
SMILES O[C@@]1([C@@]([C@@](CC(C1)(C)C)(OC)C)(Br)[H])[H]
SPLASH splash10-000i-0910000000-86dccc60a8154c0c1023
Source of Spectrum F-46-4213-3
Synonyms (1S,2S,3R)-2-bromo-3-methoxy-3,5,5-trimethylcyclohexanol 2(a)-bromo-1(E)-hydroxy-3(a)-methoxy-3,5,5-trimethylcyclohexane
Wiley ID 1252728