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2,3-DIHYDRO-4-(PARA-METHOXYPHENYL)-7-PHENOXY-1H-1,5-BENZODIAZEPINE-2-THIONE
SpectraBase Compound ID FaEn4CgiQyl
InChI InChI=1S/C22H18N2O2S/c1-25-16-9-7-15(8-10-16)20-14-22(27)24-19-12-11-18(13-21(19)23-20)26-17-5-3-2-4-6-17/h2-13H,14H2,1H3,(H,24,27)
InChIKey SGAUYJBHGMIUGL-UHFFFAOYSA-N
Mol Weight 374.46 g/mol
Molecular Formula C22H18N2O2S
Exact Mass 374.108899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7DctxLqZZ0g
Name 2,3-DIHYDRO-4-(PARA-METHOXYPHENYL)-7-PHENOXY-1H-1,5-BENZODIAZEPINE-2-THIONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H18N2O2S
InChI InChI=1S/C22H18N2O2S/c1-25-16-9-7-15(8-10-16)20-14-22(27)24-19-12-11-18(13-21(19)23-20)26-17-5-3-2-4-6-17/h2-13H,14H2,1H3,(H,24,27)
InChIKey SGAUYJBHGMIUGL-UHFFFAOYSA-N
Literature Reference Author E.C.CORTES,C.M.A.CASTREJON
Literature Reference Citation J.HETCYCL.CHEM.,34,1809(1997)
Literature Reference DOI 10.1002/jhet.5570340628
Molecular Weight 374.457 g/mol
Solvent DMSO-D6
Source File Reference UWSW298