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5,2,9-Ethanylylidene-1-benzoxepin-11-one, 3,7-dichloro-2,5,5a,6,9,9a-hexahydro-6-hydroxy-, (2.alpha.,5.alpha.,5a.beta.,6.beta.,9.alpha.,9a.beta.,10S*)-
SpectraBase Compound ID 11Vm3XI7CRH
InChI InChI=1S/C12H10Cl2O3/c13-5-2-4-8-9(15)3-1-6(14)12(8)17-11(4)7(3)10(5)16/h1-4,7-8,10-12,16H
InChIKey CTZZHCIPPLEWCC-UHFFFAOYSA-N
Mol Weight 273.11 g/mol
Molecular Formula C12H10Cl2O3
Exact Mass 272.0007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2r7X9mi8KMO
Name 5,2,9-Ethanylylidene-1-benzoxepin-11-one, 3,7-dichloro-2,5,5a,6,9,9a-hexahydro-6-hydroxy-, (2.alpha.,5.alpha.,5a.beta.,6.beta.,9.alpha.,9a.beta.,10S*)-
CAS Registry Number 83116-21-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Cl2O3
InChI InChI=1S/C12H10Cl2O3/c13-5-2-4-8-9(15)3-1-6(14)12(8)17-11(4)7(3)10(5)16/h1-4,7-8,10-12,16H
InChIKey CTZZHCIPPLEWCC-UHFFFAOYSA-N
Molecular Weight 273.115 g/mol
SMILES OC1C(=CC2C3C1C1C(C2C(O3)C(=C1)Cl)=O)Cl
SPLASH splash10-0ab9-1940000000-591b9468d948186a04fa
Source of Spectrum H-65-1010-0
Synonyms 6,12-dichloro-7-hydroxy-10-oxatetracyclo[6.5.0.0(3,11).0(4,9)]trideca-5,12-dien-2-one 6,12-Dichloro-7exo-hydroxy-10-oxatetracyclo[6.5.0.0(3,11).0(4,9)]trideca-5,12-dien-2-one
Wiley ID 1275742