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5-Mercapto-5-(4-methoxy-phenyl)-1,4-diphenyl-pyr

View entire compound with spectra: 2 NMR

5-Mercapto-5-(4-methoxy-phenyl)-1,4-diphenyl-pyr
SpectraBase Compound ID 6lapFEhhzqx
InChI InChI=1S/C23H21NO2S/c1-26-20-14-12-18(13-15-20)23(27)21(17-8-4-2-5-9-17)16-22(25)24(23)19-10-6-3-7-11-19/h2-15,21,27H,16H2,1H3
InChIKey NOFXWVCOHCEPNA-UHFFFAOYSA-N
Mol Weight 375.49 g/mol
Molecular Formula C23H21NO2S
Exact Mass 375.1293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhQHqGQXhsq
Name 5-Mercapto-5-(4-methoxy-phenyl)-1,4-diphenyl-pyr
Comments MINOR STEREOISOMER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H21NO2S
InChI InChI=1S/C23H21NO2S/c1-26-20-14-12-18(13-15-20)23(27)21(17-8-4-2-5-9-17)16-22(25)24(23)19-10-6-3-7-11-19/h2-15,21,27H,16H2,1H3
InChIKey NOFXWVCOHCEPNA-UHFFFAOYSA-N
Instrument Name Jeol GX-270
Literature Reference M. Sakamoto, M. Tohnishi, T. Fujita, J. Chem. Soc. Perkin I 347 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3