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4-(2-Mercapto-1-methoxycarbonyl-1-methyl-ethyl)-2,6-diphenyl-pyrimidine

View entire compound with spectra: 1 NMR

4-(2-Mercapto-1-methoxycarbonyl-1-methyl-ethyl)-2,6-diphenyl-pyrimidine
SpectraBase Compound ID 1gA9Ph6I5fD
InChI InChI=1S/C21H20N2O2S/c1-21(14-26,20(24)25-2)18-13-17(15-9-5-3-6-10-15)22-19(23-18)16-11-7-4-8-12-16/h3-13,26H,14H2,1-2H3
InChIKey IIMVIAGZYHBJEV-UHFFFAOYSA-N
Mol Weight 364.46 g/mol
Molecular Formula C21H20N2O2S
Exact Mass 364.124549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CytdcEpdeMt
Name 4-(2-Mercapto-1-methoxycarbonyl-1-methyl-ethyl)-2,6-diphenyl-pyrimidine
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H20N2O2S
InChI InChI=1S/C21H20N2O2S/c1-21(14-26,20(24)25-2)18-13-17(15-9-5-3-6-10-15)22-19(23-18)16-11-7-4-8-12-16/h3-13,26H,14H2,1-2H3
InChIKey IIMVIAGZYHBJEV-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference T. Nishio, M. Fujisawa, Y. Omote, J. Chem. Soc. Perkin I 2523 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3