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2-Iodomethyl-4-methyl-N-(4-methoxy-phenyl)-1,3-butadiene-1,4-sultame
SpectraBase Compound ID LtFcSP9Rzik
InChI InChI=1S/C13H14INO3S/c1-10-7-11(8-14)9-19(16,17)15(10)12-3-5-13(18-2)6-4-12/h3-7,9H,8H2,1-2H3
InChIKey KGCSQSPVDANBPD-UHFFFAOYSA-N
Mol Weight 391.22 g/mol
Molecular Formula C13H14INO3S
Exact Mass 390.973909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7WFKxLTpyvP
Name 2-Iodomethyl-4-methyl-N-(4-methoxy-phenyl)-1,3-butadiene-1,4-sultame
CAS Registry Number 100033-36-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H14INO3S
InChI InChI=1S/C13H14INO3S/c1-10-7-11(8-14)9-19(16,17)15(10)12-3-5-13(18-2)6-4-12/h3-7,9H,8H2,1-2H3
InChIKey KGCSQSPVDANBPD-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference E. Fanghaenel, H. Mohammed, A.M. Richter, J. Prakt. Chem. 327, 428 (1985).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3