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(4S,10R)-5,11-Dichloro-4,10-diethoxy-4,10-dihydro-dibenzo[ef,kl]heptalene
SpectraBase Compound ID 9aJSkXStbUR
InChI InChI=1S/C22H20Cl2O2/c1-3-25-21-15-9-5-7-14-12-18(24)22(26-4-2)16-10-6-8-13(11-17(21)23)20(16)19(14)15/h5-12,21-22H,3-4H2,1-2H3/t21-,22+
InChIKey HZFFYUDQDXMUDF-SZPZYZBQSA-N
Mol Weight 387.31 g/mol
Molecular Formula C22H20Cl2O2
Exact Mass 386.084035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgmxNTtF9Y
Name (4S,10R)-5,11-Dichloro-4,10-diethoxy-4,10-dihydro-dibenzo[ef,kl]heptalene
Alternate Name(s) (4R,10S)-5,11-dichloro-4,10-diethoxy-4,10-dihydrodibenzo[ef,kl]heptalene endo,exo-5,11-Dichloro-4,10-diethoxy-4,10-dihydrodibenzo[ef,kl]heptalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20Cl2O2
InChI InChI=1S/C22H20Cl2O2/c1-3-25-21-15-9-5-7-14-12-18(24)22(26-4-2)16-10-6-8-13(11-17(21)23)20(16)19(14)15/h5-12,21-22H,3-4H2,1-2H3/t21-,22+
InChIKey HZFFYUDQDXMUDF-SZPZYZBQSA-N
Molecular Weight 387.306 g/mol
SMILES c12-c3c4[C@@](OCC)([H])C(=Cc2cccc1[C@](C(Cl)=Cc3ccc4)(OCC)[H])Cl
SPLASH splash10-0udi-0192000000-fdbae73b3ce02d774f66
Source of Spectrum K-2002-550-1
Wiley ID 1581393