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(+/-)-(1R*,2R*,3S*,6R*,7S*,8S*)-1,8,9,10-TETRACHLORO-11,11-DIMETHOXYTRICYCLO-[6.2.1.0(2,7)]-UNDEC-9-EN-3,6-DIOL
SpectraBase Compound ID GKqjTiPoapJ
InChI InChI=1S/C13H16Cl4O4/c1-20-13(21-2)11(16)7-5(18)3-4-6(19)8(7)12(13,17)10(15)9(11)14/h5-8,18-19H,3-4H2,1-2H3/t5-,6+,7-,8+,11-,12+
InChIKey UYUMRQNLUKPSBK-OCYKKEQTSA-N
Mol Weight 378.1 g/mol
Molecular Formula C13H16Cl4O4
Exact Mass 375.98027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6MGUTOWo6pP
Name (1R*,2R*,3S*,6R*,7S*,8S*)-1,8,9,10-Tetrachloro-11,11-dimethoxytricyclo[6.2.1.0(2,7)]undec-9-ene-3,6-diol
Alternate Name(s) (1R,2R,3S,6R,7S,8S)-1,8,9,10-tetrachloro-11,11-dimethoxytricyclo[6.2.1.0(2,7)]undec-9-ene-3,6-diol
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Formula C13H16Cl4O4
InChI InChI=1S/C13H16Cl4O4/c1-20-13(21-2)11(16)7-5(18)3-4-6(19)8(7)12(13,17)10(15)9(11)14/h5-8,18-19H,3-4H2,1-2H3/t5-,6+,7-,8+,11-,12+
InChIKey UYUMRQNLUKPSBK-OCYKKEQTSA-N
Molecular Weight 378.079 g/mol
SMILES O[C@]1([C@]2([C@@]3(C([C@]([C@]2([C@](CC1)(O)[H])[H])(C(=C3Cl)Cl)Cl)(OC)OC)Cl)[H])[H]
SPLASH splash10-0a4i-0095000000-10868fe8f9a73aa4faff
Source of Spectrum AH-125-778-4
Wiley ID 1357409