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(1R*,2R*,3S*,6R*,7S*,8S*)-1,8,9,10-Tetrachloro-11,11-dimethoxy-6-hydroxytricyclo[6.2.1.0(2,7)]undeca-4,9-dien-3-yl acetate
SpectraBase Compound ID 7IxMJt1ole0
InChI InChI=1S/C15H16Cl4O5/c1-6(20)24-8-5-4-7(21)9-10(8)14(19)12(17)11(16)13(9,18)15(14,22-2)23-3/h4-5,7-10,21H,1-3H3/t7-,8+,9-,10+,13-,14+/m1/s1
InChIKey CSFFGEJMMANOEU-KNLLEVFCSA-N
Mol Weight 418.1 g/mol
Molecular Formula C15H16Cl4O5
Exact Mass 415.975184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LusnDE2g42
Name (1R*,2R*,3S*,6R*,7S*,8S*)-1,8,9,10-Tetrachloro-11,11-dimethoxy-6-hydroxytricyclo[6.2.1.0(2,7)]undeca-4,9-dien-3-yl acetate
Alternate Name(s) (1R,2R,3S,6R,7S,8S)-1,8,9,10-tetrachloro-6-hydroxy-11,11-dimethoxytricyclo[6.2.1.0(2,7)]undeca-4,9-dien-3-yl acetate
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Formula C15H16Cl4O5
InChI InChI=1S/C15H16Cl4O5/c1-6(20)24-8-5-4-7(21)9-10(8)14(19)12(17)11(16)13(9,18)15(14,22-2)23-3/h4-5,7-10,21H,1-3H3/t7-,8+,9-,10+,13-,14+/m1/s1
InChIKey CSFFGEJMMANOEU-KNLLEVFCSA-N
Molecular Weight 418.100 g/mol
SMILES O[C@]1([C@@]2([C@@]([C@]3(C([C@]2(Cl)C(=C3Cl)Cl)(OC)OC)Cl)([C@](C=C1)(OC(=O)C)[H])[H])[H])[H]
SPLASH splash10-0a4i-6092000000-098f5895ea078847ac2a
Source of Spectrum AH-124-1162-2
Wiley ID 1376169