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8,8-DIMETHYL-3-(3-NITROPHENYL)-2-PHENYL-1-OXA-2,7-DIAZASPIRO-[4.4]-NONANE-6-THIONE
SpectraBase Compound ID 3NrQGXd8C2C
InChI InChI=1S/C20H21N3O3S/c1-19(2)13-20(18(27)21-19)12-17(14-7-6-10-16(11-14)23(24)25)22(26-20)15-8-4-3-5-9-15/h3-11,17H,12-13H2,1-2H3,(H,21,27)/t17-,20+/m0/s1
InChIKey ONLJGFVMEWVFDI-FXAWDEMLSA-N
Mol Weight 383.47 g/mol
Molecular Formula C20H21N3O3S
Exact Mass 383.130363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 46GN9IhjYu7
Name 8,8-DIMETHYL-3-(3-NITROPHENYL)-2-PHENYL-1-OXA-2,7-DIAZASPIRO-[4.4]-NONANE-6-THIONE
Compound Number 10E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21N3O3S
InChI InChI=1S/C20H21N3O3S/c1-19(2)13-20(18(27)21-19)12-17(14-7-6-10-16(11-14)23(24)25)22(26-20)15-8-4-3-5-9-15/h3-11,17H,12-13H2,1-2H3,(H,21,27)/t17-,20+/m0/s1
InChIKey ONLJGFVMEWVFDI-FXAWDEMLSA-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 383.465 g/mol
Solvent CDCl3
Source File Reference UWCP2618