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5-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID DsFmIZUG64I
InChI InChI=1S/C20H13Cl2N3O2S/c21-13-6-5-11(16(22)8-13)9-25-10-12(14-3-1-2-4-17(14)25)7-15-18(26)23-20(28)24-19(15)27/h1-8,10H,9H2,(H2,23,24,26,27,28)
InChIKey HUVZYCGFCLTPTE-UHFFFAOYSA-N
Mol Weight 430.31 g/mol
Molecular Formula C20H13Cl2N3O2S
Exact Mass 429.010553 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CU2Nd0FUVVY
Name 5-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]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/C20H13Cl2N3O2S/c21-13-6-5-11(16(22)8-13)9-25-10-12(14-3-1-2-4-17(14)25)7-15-18(26)23-20(28)24-19(15)27/h1-8,10H,9H2,(H2,23,24,26,27,28)
InChIKey HUVZYCGFCLTPTE-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_651
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: UZI/1007595; UBI_ID: UBI-000652
Temperature 315 °C