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3,3-Bis(methylthio)-1-(4-nitro-phenyl)-prop-2-en-1-one

View entire compound with spectra: 3 NMR, and 1 MS (GC)

3,3-Bis(methylthio)-1-(4-nitro-phenyl)-prop-2-en-1-one
SpectraBase Compound ID 2ugzTNaOkFu
InChI InChI=1S/C11H11NO3S2/c1-16-11(17-2)7-10(13)8-3-5-9(6-4-8)12(14)15/h3-7H,1-2H3
InChIKey ZRMKIXVMEJWMDA-UHFFFAOYSA-N
Mol Weight 269.33 g/mol
Molecular Formula C11H11NO3S2
Exact Mass 269.018036 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IgJgBqahoMH
Name 3,3-Bis(methylthio)-1-(4-nitro-phenyl)-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 C11H11NO3S2
InChI InChI=1S/C11H11NO3S2/c1-16-11(17-2)7-10(13)8-3-5-9(6-4-8)12(14)15/h3-7H,1-2H3
InChIKey ZRMKIXVMEJWMDA-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