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N-tert-Butyl-N-(1-methylthio-2,3-dicyano-3,3-diphenyl-1-propenyl)-carbamic acid, methyl ester
SpectraBase Compound ID 9hpESmCUlQG
InChI InChI=1S/C24H25N3O2S/c1-23(2,3)27(22(28)29-4)21(30-5)20(16-25)24(17-26,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15H,1-5H3/b21-20+
InChIKey NGCCGTAYIUMAEI-QZQOTICOSA-N
Mol Weight 419.54 g/mol
Molecular Formula C24H25N3O2S
Exact Mass 419.166748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3iXsieSFMok
Name N-tert-Butyl-N-(1-methylthio-2,3-dicyano-3,3-diphenyl-1-propenyl)-carbamic acid, methyl ester
Comments SHIFTS FOR PHENYL ,CYANO AND C-2 ASSIGNED BY S.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H25N3O2S
InChI InChI=1S/C24H25N3O2S/c1-23(2,3)27(22(28)29-4)21(30-5)20(16-25)24(17-26,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15H,1-5H3/b21-20+
InChIKey NGCCGTAYIUMAEI-QZQOTICOSA-N
Instrument Name Bruker WP-80
Literature Reference G. Morel, E. Marchand, Tetrahedron 40, 1075 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3