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2-Benzoyl-5,6,8,9-Tetrachloro-3-(4-fluorophenyl)-1-oxaspiro[3.5]nona-5,8-dien-7-one
SpectraBase Compound ID 3DSnfHWvzq5
InChI InChI=1S/C21H11Cl4FO3/c22-14-17(28)15(23)20(25)21(19(14)24)13(10-6-8-12(26)9-7-10)18(29-21)16(27)11-4-2-1-3-5-11/h1-9,13,18H/t13-,18+/m1/s1
InChIKey WMUKFNABEXBXHO-ACJLOTCBSA-N
Mol Weight 472.1 g/mol
Molecular Formula C21H11Cl4FO3
Exact Mass 469.944633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID s7ibwUDDM
Name 2-Benzoyl-5,6,8,9-Tetrachloro-3-(4-fluorophenyl)-1-oxaspiro[3.5]nona-5,8-dien-7-one
Alternate Name(s) (2S,3R)-2-Benzoyl-5,6,8,9-tetrachloro-3-(4-fluoro-phenyl)-1-oxa-spiro[3.5]nona-5,8-dien-7-one (2S,3R)-5,6,8,9-tetrakis(chloranyl)-3-(4-fluorophenyl)-2-(phenylcarbonyl)-1-oxaspiro[3.5]nona-5,8-dien-7-one
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Formula C21H11Cl4FO3
InChI InChI=1S/C21H11Cl4FO3/c22-14-17(28)15(23)20(25)21(19(14)24)13(10-6-8-12(26)9-7-10)18(29-21)16(27)11-4-2-1-3-5-11/h1-9,13,18H/t13-,18+/m1/s1
InChIKey WMUKFNABEXBXHO-ACJLOTCBSA-N
Molecular Weight 472.126 g/mol
SMILES C12(C(=C(Cl)C(C(=C2Cl)Cl)=O)Cl)[C@](c2ccc(cc2)F)([C@](O1)(C(=O)c1ccccc1)[H])[H]
SPLASH splash10-0a6r-0690000000-195308fb23f426363041
Source of Spectrum KC-0-577-31
Wiley ID 780663