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1-(1-Cyano-1-mercaptomethyl-ethyl)-3,5-diphenyl-pyrimidine

View entire compound with spectra: 1 NMR

1-(1-Cyano-1-mercaptomethyl-ethyl)-3,5-diphenyl-pyrimidine
SpectraBase Compound ID GIeYz9G2Hds
InChI InChI=1S/C20H17N3S/c1-20(13-21,14-24)19-22-17(15-8-4-2-5-9-15)12-18(23-19)16-10-6-3-7-11-16/h2-12,24H,14H2,1H3
InChIKey RKBAXDWZGVXXJD-UHFFFAOYSA-N
Mol Weight 331.44 g/mol
Molecular Formula C20H17N3S
Exact Mass 331.114319 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8pnb9gM3r2K
Name 1-(1-Cyano-1-mercaptomethyl-ethyl)-3,5-diphenyl-pyrimidine
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H17N3S
InChI InChI=1S/C20H17N3S/c1-20(13-21,14-24)19-22-17(15-8-4-2-5-9-15)12-18(23-19)16-10-6-3-7-11-16/h2-12,24H,14H2,1H3
InChIKey RKBAXDWZGVXXJD-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