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1,2-Cyclohexanediol, 3-bromo-1-ethyl-, (1.alpha.,2.alpha.,3.beta.)-
SpectraBase Compound ID CE745zVWf0C
InChI InChI=1S/C8H15BrO2/c1-2-8(11)5-3-4-6(9)7(8)10/h6-7,10-11H,2-5H2,1H3/t6-,7+,8-/m0/s1
InChIKey PIKOWMQVJCSZDW-RNJXMRFFSA-N
Mol Weight 223.11 g/mol
Molecular Formula C8H15BrO2
Exact Mass 222.025543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kjpzrDeisR
Name 1,2-Cyclohexanediol, 3-bromo-1-ethyl-, (1.alpha.,2.alpha.,3.beta.)-
CAS Registry Number 89782-52-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15BrO2
InChI InChI=1S/C8H15BrO2/c1-2-8(11)5-3-4-6(9)7(8)10/h6-7,10-11H,2-5H2,1H3/t6-,7+,8-/m0/s1
InChIKey PIKOWMQVJCSZDW-RNJXMRFFSA-N
Molecular Weight 223.110 g/mol
SMILES O[C@@]1([C@@]([C@](CCC1)(Br)[H])(O)[H])CC
SPLASH splash10-0avi-9000000000-1bed72208a368d5e370c
Source of Spectrum AC-1983-243-0
Synonyms (1S,2S,3S)-3-bromo-1-ethyl-1,2-cyclohexanediol 3t-bromo-1-ethyl-1c,2R-cyclohexanediol
Wiley ID 1221728