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Tetracyclo[4.3.1.1(2,5).0(7,9)]undec-3-en-10-one, 11-(acetyloxy)-8,8-dichloro-, stereoisomer
SpectraBase Compound ID CrLDcyed7Ly
InChI InChI=1S/C13H12Cl2O3/c1-4(16)18-12-5-2-3-6(12)8-10-9(13(10,14)15)7(5)11(8)17/h2-3,5-10,12H,1H3/t5-,6+,7-,8-,9?,10?,12?/m0/s1
InChIKey UNHPUGAUXGZVNO-UHFFFAOYSA-N
Mol Weight 287.14 g/mol
Molecular Formula C13H12Cl2O3
Exact Mass 286.01635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ozfABJ8R0z
Name Tetracyclo[4.3.1.1(2,5).0(7,9)]undec-3-en-10-one, 11-(acetyloxy)-8,8-dichloro-, stereoisomer
CAS Registry Number 78630-62-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12Cl2O3
InChI InChI=1S/C13H12Cl2O3/c1-4(16)18-12-5-2-3-6(12)8-10-9(13(10,14)15)7(5)11(8)17/h2-3,5-10,12H,1H3/t5-,6+,7-,8-,9?,10?,12?/m0/s1
InChIKey UNHPUGAUXGZVNO-UHFFFAOYSA-N
Molecular Weight 287.142 g/mol
SMILES C1(C2[C@@]3([C@]4(C=C[C@@]([C@@](C12)(C3=O)[H])(C4OC(=O)C)[H])[H])[H])(Cl)Cl
SPLASH splash10-0006-9510000000-65fcac1800449bef2cac
Source of Spectrum H-64-1011-0
Synonyms 8,8-Dichloro-10-oxotetracyclo[4.3.1.1(2,5).0(7,9)]undec-3-en-11-yl acetate [anti(10,11),syn(8,10)-8,8-dichloro-10-oxotetracyclo[4.3.1.1(2,5).0(7.9)]undec-3-en-11endo-yl]ester of acetic acid
Wiley ID 1289441