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(1-ALPHA,3-BETA,5-BETA,7-ALPHA)-4,4-DICHLORO-8,8-DIMETHYLTRICYClO-[5.1.0.0]-OCTANE-1,7-DICARBOXYLIC-ACID
SpectraBase Compound ID HWsyIkWzrLp
InChI InChI=1S/C12H14Cl2O4/c1-9(2)10(7(15)16)3-5-6(12(5,13)14)4-11(9,10)8(17)18/h5-6H,3-4H2,1-2H3,(H,15,16)(H,17,18)/t5-,6+,10-,11+
InChIKey JHGVXDDNWYJNES-QLJCSWHUSA-N
Mol Weight 293.15 g/mol
Molecular Formula C12H14Cl2O4
Exact Mass 292.026914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZVPwcvAORC
Name (1a,3b,5b,7a)-4,4-dichloro-8,8-dimethyltricyclo[5.1.0.03,5]octane-1,7-dicarboxylic acid
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Formula C12H14Cl2O4
InChI InChI=1S/C12H14Cl2O4/c1-9(2)10(7(15)16)3-5-6(12(5,13)14)4-11(9,10)8(17)18/h5-6H,3-4H2,1-2H3,(H,15,16)(H,17,18)/t5-,6+,10-,11+
InChIKey JHGVXDDNWYJNES-QLJCSWHUSA-N
Molecular Weight 293.146 g/mol
SMILES OC([C@@]12[C@](C(=O)O)(C[C@]3([C@@](C2)(C3(Cl)Cl)[H])[H])C1(C)C)=O
SPLASH splash10-00kf-9330000000-91a1dd3eb3297533f722
Source of Spectrum B-48-469-0
Synonyms (1R,3R,5S,7S)-4,4-dichloro-8,8-dimethyltricyclo[5.1.0.0(3,5)]octane-1,7-dicarboxylic acid
Wiley ID 1294986