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METHYL-(E)-N-[3-(4-NITROPHENYL)-3-OXO-PROPENYL]-N-PHENYL-DITHIOCARBAMATE
SpectraBase Compound ID HmghA7aLXzT
InChI InChI=1S/C17H14N2O3S2/c1-24-17(23)18(14-5-3-2-4-6-14)12-11-16(20)13-7-9-15(10-8-13)19(21)22/h2-12H,1H3/b12-11+
InChIKey KQRDQAAPYAPJPF-VAWYXSNFSA-N
Mol Weight 358.43 g/mol
Molecular Formula C17H14N2O3S2
Exact Mass 358.044585 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CKrmCXziYjM
Name METHYL-(E)-N-[3-(4-NITROPHENYL)-3-OXO-PROPENYL]-N-PHENYL-DITHIOCARBAMATE
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14N2O3S2
InChI InChI=1S/C17H14N2O3S2/c1-24-17(23)18(14-5-3-2-4-6-14)12-11-16(20)13-7-9-15(10-8-13)19(21)22/h2-12H,1H3/b12-11+
InChIKey KQRDQAAPYAPJPF-VAWYXSNFSA-N
Literature Reference Author E.KLEINPETER,S.THOMAS,G.UHLIG,W.D.RUDORF
Literature Reference Citation MAGN.RES.CHEM.,31,714(1993)
Literature Reference DOI 10.1002/mrc.1260310805
Molecular Weight 358.430 g/mol
Solvent CDCl3:TMS
Source File Reference UWRK1195