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Methyl N-tert-butyl-N-([2-cyano-2Z-(4-tolyl)-1-methylthio]-vinyl) carbamate
SpectraBase Compound ID E1toQ6D60MZ
InChI InChI=1S/C17H22N2O2S/c1-12-7-9-13(10-8-12)14(11-18)15(22-6)19(16(20)21-5)17(2,3)4/h7-10H,1-6H3/b15-14+
InChIKey AAPGTXNYPIQMJW-CCEZHUSRSA-N
Mol Weight 318.44 g/mol
Molecular Formula C17H22N2O2S
Exact Mass 318.140199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AOlbjvKH6Dn
Name Methyl N-tert-butyl-N-([2-cyano-2Z-(4-tolyl)-1-methylthio]-vinyl) carbamate
Comments AROMATIC SHIFTS ASSIGNED BY S.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H22N2O2S
InChI InChI=1S/C17H22N2O2S/c1-12-7-9-13(10-8-12)14(11-18)15(22-6)19(16(20)21-5)17(2,3)4/h7-10H,1-6H3/b15-14+
InChIKey AAPGTXNYPIQMJW-CCEZHUSRSA-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