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(2E,5E)-3-allyl-5-(4-methoxybenzylidene)-2-(phenylimino)-1,3-thiazolidin-4-one
SpectraBase Compound ID HFelUcctKpc
InChI InChI=1S/C20H18N2O2S/c1-3-13-22-19(23)18(14-15-9-11-17(24-2)12-10-15)25-20(22)21-16-7-5-4-6-8-16/h3-12,14H,1,13H2,2H3/b18-14+,21-20+
InChIKey CWFPVUQTQRHKSR-SXFBWKAHSA-N
Mol Weight 350.44 g/mol
Molecular Formula C20H18N2O2S
Exact Mass 350.108899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ze9mlMFXfX
Name (2E,5E)-3-Allyl-5-(4-methoxybenzylidene)-2-(phenylimino)-1,3-thiazolidin-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.108899000 u
Formula C20H18N2O2S
InChI InChI=1S/C20H18N2O2S/c1-3-13-22-19(23)18(14-15-9-11-17(24-2)12-10-15)25-20(22)21-16-7-5-4-6-8-16/h3-12,14H,1,13H2,2H3/b18-14+,21-20+
InChIKey CWFPVUQTQRHKSR-SXFBWKAHSA-N
Molecular Weight 350.436 g/mol
SMILES C1(N(\C(S\C1=C/C1=CC=C(C=C1)OC)=N/C=1C=CC=CC1)CC=C)=O