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2-(P-Tolylsulfonylamino)-hepta-5,6-dienoic acid, ethyl ester
SpectraBase Compound ID J1nNzU7cHKe
InChI InChI=1S/C16H21NO4S/c1-4-6-7-8-15(16(18)21-5-2)17-22(19,20)14-11-9-13(3)10-12-14/h6,9-12,15,17H,1,5,7-8H2,2-3H3
InChIKey XRNCTMRLXZQGQP-UHFFFAOYSA-N
Mol Weight 323.41 g/mol
Molecular Formula C16H21NO4S
Exact Mass 323.119129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JfkFgUP3evw
Name 2-(P-Tolylsulfonylamino)-hepta-5,6-dienoic acid, ethyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H21NO4S
InChI InChI=1S/C16H21NO4S/c1-4-6-7-8-15(16(18)21-5-2)17-22(19,20)14-11-9-13(3)10-12-14/h6,9-12,15,17H,1,5,7-8H2,2-3H3
InChIKey XRNCTMRLXZQGQP-UHFFFAOYSA-N
Instrument Name Jeol GX-270
Literature Reference N.J. Huby, R.G. Kinsman, T. Gallagher, J. Chem. Soc. Perkin I 145 (1991).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3