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7-(META-METHOXYPHENOXY)-4-(PARA-METHOXYPHENYL)-2-METHYLTHIO-3H-[1,5]-BENZODIAZEPINE
SpectraBase Compound ID 3CbEkXUrdL4
InChI InChI=1S/C24H22N2O3S/c1-27-17-9-7-16(8-10-17)22-15-24(30-3)26-21-12-11-20(14-23(21)25-22)29-19-6-4-5-18(13-19)28-2/h4-14H,15H2,1-3H3
InChIKey QQFBLUSLBORPKT-UHFFFAOYSA-N
Mol Weight 418.51 g/mol
Molecular Formula C24H22N2O3S
Exact Mass 418.135114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9iuTbabxEIr
Name 7-(META-METHOXYPHENOXY)-4-(PARA-METHOXYPHENYL)-2-METHYLTHIO-3H-[1,5]-BENZODIAZEPINE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H22N2O3S
InChI InChI=1S/C24H22N2O3S/c1-27-17-9-7-16(8-10-17)22-15-24(30-3)26-21-12-11-20(14-23(21)25-22)29-19-6-4-5-18(13-19)28-2/h4-14H,15H2,1-3H3
InChIKey QQFBLUSLBORPKT-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 418.510 g/mol
Solvent CDCl3
Source File Reference UWSI20982