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Cyclohexane, 2-bromo-1,3-dimethoxy-, (1.alpha.,2.alpha.,3.beta.)-(.+-.)-
SpectraBase Compound ID GHBsVirtfDV
InChI InChI=1S/C8H15BrO2/c1-10-6-4-3-5-7(11-2)8(6)9/h6-8H,3-5H2,1-2H3/t6-,7-/m0/s1
InChIKey JAXMWPMVPGIVBX-BQBZGAKWSA-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 8F9kkl0qz8H
Name Cyclohexane, 2-bromo-1,3-dimethoxy-, (1.alpha.,2.alpha.,3.beta.)-(.+-.)-
Alternate Name(s) (1S,3S)-2-bromo-1,3-dimethoxycyclohexane 2(E)-bromo-1(a),3(E)-dimethoxycyclohexane
CAS Registry Number 131287-10-0
Comments Less than 3 mono-isotopic peaks
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Formula C8H15BrO2
InChI InChI=1S/C8H15BrO2/c1-10-6-4-3-5-7(11-2)8(6)9/h6-8H,3-5H2,1-2H3/t6-,7-/m0/s1
InChIKey JAXMWPMVPGIVBX-BQBZGAKWSA-N
Molecular Weight 223.110 g/mol
SMILES C1([C@@](OC)(CCC[C@@]1(OC)[H])[H])Br
SPLASH splash10-0006-9030000000-095f5b22a1117aba2e71
Source of Spectrum F-46-4213-1
Wiley ID 1221729