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1-(4-Butoxy-phenyl)-3,3-bis(methylthio)-prop-2-en-1-one

View entire compound with spectra: 2 NMR

1-(4-Butoxy-phenyl)-3,3-bis(methylthio)-prop-2-en-1-one
SpectraBase Compound ID 4BeISyw8KUJ
InChI InChI=1S/C15H20O2S2/c1-4-5-10-17-13-8-6-12(7-9-13)14(16)11-15(18-2)19-3/h6-9,11H,4-5,10H2,1-3H3
InChIKey PWKHMMXKZVYSFR-UHFFFAOYSA-N
Mol Weight 296.44 g/mol
Molecular Formula C15H20O2S2
Exact Mass 296.090472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EBgY7OBvAMj
Name 1-(4-Butoxy-phenyl)-3,3-bis(methylthio)-prop-2-en-1-one
Comments 20 MHZ OR 50 MHZ SPECTRUM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H20O2S2
InChI InChI=1S/C15H20O2S2/c1-4-5-10-17-13-8-6-12(7-9-13)14(16)11-15(18-2)19-3/h6-9,11H,4-5,10H2,1-3H3
InChIKey PWKHMMXKZVYSFR-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference G. Fischer, W-D. Rudorf, E. Kleinpeter, Magn. Res. Chem. 29, 212 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3