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cis-(1S,2R)-1,2-Dihydroxy-3-ethyl-4-chlorocyclohexa-3,5-diene
SpectraBase Compound ID 87OoswiHuKF
InChI InChI=1S/C8H11ClO2/c1-2-5-6(9)3-4-7(10)8(5)11/h3-4,7-8,10-11H,2H2,1H3/t7-,8+/m0/s1
InChIKey XEOGPBVIXQLANI-JGVFFNPUSA-N
Mol Weight 174.63 g/mol
Molecular Formula C8H11ClO2
Exact Mass 174.044757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5RjzYUwRT0
Name cis-(1S,2R)-1,2-Dihydroxy-3-ethyl-4-chlorocyclohexa-3,5-diene
Alternate Name(s) (1S,2R)-4-chloro-3-ethylcyclohexa-3,5-diene-1,2-diol (1S,2R)-4-chloranyl-3-ethyl-cyclohexa-3,5-diene-1,2-diol
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Formula C8H11ClO2
InChI InChI=1S/C8H11ClO2/c1-2-5-6(9)3-4-7(10)8(5)11/h3-4,7-8,10-11H,2H2,1H3/t7-,8+/m0/s1
InChIKey XEOGPBVIXQLANI-JGVFFNPUSA-N
Molecular Weight 174.627 g/mol
SMILES O[C@@]1(C(=C(C=C[C@@]1(O)[H])Cl)CC)[H]
SPLASH splash10-0006-9700000000-117b187315e1840e3994
Source of Spectrum F5-4-3347-3B
Wiley ID 1732973