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(5E)-1-(3-methylphenyl)-5-{[5-(4-morpholinyl)-2-furyl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID 2gh9zB4bkai
InChI InChI=1S/C20H19N3O4S/c1-13-3-2-4-14(11-13)23-19(25)16(18(24)21-20(23)28)12-15-5-6-17(27-15)22-7-9-26-10-8-22/h2-6,11-12H,7-10H2,1H3,(H,21,24,28)/b16-12+
InChIKey FXXQPDDEIOQLBR-FOWTUZBSSA-N
Mol Weight 397.45 g/mol
Molecular Formula C20H19N3O4S
Exact Mass 397.109627 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID VEBFoMkf4F
Name (5E)-1-(3-methylphenyl)-5-{[5-(4-morpholinyl)-2-furyl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H19N3O4S/c1-13-3-2-4-14(11-13)23-19(25)16(18(24)21-20(23)28)12-15-5-6-17(27-15)22-7-9-26-10-8-22/h2-6,11-12H,7-10H2,1H3,(H,21,24,28)/b16-12+
InChIKey FXXQPDDEIOQLBR-FOWTUZBSSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3588
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 113228; Labnumber: PAVL-28382; VK_ID: VK-003589
Synonyms 1-(3-methylphenyl)-5-{[5-(4-morpholinyl)-2-furyl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 313 °C