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3-(2,4-DICHLOROBENZOYL)-8,8-DIMETHYL-2-PHENYL-1-OXA-2,7-DIAZASPIRO-[4.4]-NONANE-6-THIONE
SpectraBase Compound ID F5iSjHmVAiA
InChI InChI=1S/C21H20Cl2N2O2S/c1-20(2)12-21(19(28)24-20)11-17(25(27-21)14-6-4-3-5-7-14)18(26)15-9-8-13(22)10-16(15)23/h3-10,17H,11-12H2,1-2H3,(H,24,28)/t17-,21+/m0/s1
InChIKey FHSVNPIIMDDUAU-LAUBAEHRSA-N
Mol Weight 435.37 g/mol
Molecular Formula C21H20Cl2N2O2S
Exact Mass 434.062254 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6cFdL5IymQL
Name 3-(2,4-DICHLOROBENZOYL)-8,8-DIMETHYL-2-PHENYL-1-OXA-2,7-DIAZASPIRO-[4.4]-NONANE-6-THIONE
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20Cl2N2O2S
InChI InChI=1S/C21H20Cl2N2O2S/c1-20(2)12-21(19(28)24-20)11-17(25(27-21)14-6-4-3-5-7-14)18(26)15-9-8-13(22)10-16(15)23/h3-10,17H,11-12H2,1-2H3,(H,24,28)/t17-,21+/m0/s1
InChIKey FHSVNPIIMDDUAU-LAUBAEHRSA-N
Literature Reference Author L.FISERA,L.JAROSKOVA,I.MATEJKOVA,H.HEIMGARTNER
Literature Reference Citation HETEROCYCLES,40,271(1995)
Literature Reference DOI 10.3987/COM-94-S22
Molecular Weight 435.368 g/mol
Solvent CDCl3
Source File Reference UWCP2614