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Tetracyclo[5.3.1.1(2,6).0(3,5)]dodecane-11,12-dione, 4,4-dichloro-, (1.alpha.,2.beta.,3.beta.,5.beta.,6.beta.,7.alpha.)-
SpectraBase Compound ID FDvr1u3INcx
InChI InChI=1S/C12H12Cl2O2/c13-12(14)8-6-4-2-1-3-5(10(4)15)7(9(8)12)11(6)16/h4-9H,1-3H2/t4-,5+,6-,7+,8+,9-
InChIKey CHPFOYPIERPCFU-LBSKAFFJSA-N
Mol Weight 259.13 g/mol
Molecular Formula C12H12Cl2O2
Exact Mass 258.021435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 238nGzrJqTB
Name Tetracyclo[5.3.1.1(2,6).0(3,5)]dodecane-11,12-dione, 4,4-dichloro-, (1.alpha.,2.beta.,3.beta.,5.beta.,6.beta.,7.alpha.)-
CAS Registry Number 83098-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12Cl2O2
InChI InChI=1S/C12H12Cl2O2/c13-12(14)8-6-4-2-1-3-5(10(4)15)7(9(8)12)11(6)16/h4-9H,1-3H2/t4-,5+,6-,7+,8+,9-
InChIKey CHPFOYPIERPCFU-LBSKAFFJSA-N
Molecular Weight 259.132 g/mol
SMILES C1([C@]2([C@]3([C@]4(CCC[C@](C4=O)([C@@]([C@@]12[H])(C3=O)[H])[H])[H])[H])[H])(Cl)Cl
SPLASH splash10-05e9-7930000000-e849369d3b32d18f174f
Source of Spectrum H-65-1018-0
Synonyms (1R,2R,3S,5R,6S,7S)-4,4-dichlorotetracyclo[5.3.1.1(2,6).0(3,5)]dodecane-11,12-dione 11anti,12, syn4,12-4,4-dichlorotetracyclo[5.3.1.1(2,6).0(3,5)]dodecan-11,12-dione
Wiley ID 1261366