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4-(PARA-METHOXYPHENYL)-2-METHYLTHIO-3H-7-PHENOXY-[1,5]-BENZODIAZEPINE
SpectraBase Compound ID 1aaWszCw8QV
InChI InChI=1S/C23H20N2O2S/c1-26-17-10-8-16(9-11-17)21-15-23(28-2)25-20-13-12-19(14-22(20)24-21)27-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3
InChIKey NXWRUCJSSLNZCA-UHFFFAOYSA-N
Mol Weight 388.49 g/mol
Molecular Formula C23H20N2O2S
Exact Mass 388.124549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K8qyO2pQIZs
Name 4-(PARA-METHOXYPHENYL)-2-METHYLTHIO-3H-7-PHENOXY-[1,5]-BENZODIAZEPINE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H20N2O2S
InChI InChI=1S/C23H20N2O2S/c1-26-17-10-8-16(9-11-17)21-15-23(28-2)25-20-13-12-19(14-22(20)24-21)27-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3
InChIKey NXWRUCJSSLNZCA-UHFFFAOYSA-N
Literature Reference Author E.C.CORTES,C.A.C.ROMERO,O.G.MELLADO
Literature Reference Citation J.HETCYCL.CHEM.,39,1321(2002)
Literature Reference DOI 10.1002/jhet.5570390633
Molecular Weight 388.484 g/mol
Solvent CDCl3
Source File Reference UWSI20980