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5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1,3-dimethyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID t9d9DsIR05
InChI InChI=1S/C20H21N3O2S/c1-12-6-8-16(9-7-12)23-13(2)10-15(14(23)3)11-17-18(24)21(4)20(26)22(5)19(17)25/h6-11H,1-5H3
InChIKey SFMYUAKECPGLJX-UHFFFAOYSA-N
Mol Weight 367.47 g/mol
Molecular Formula C20H21N3O2S
Exact Mass 367.135448 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G3n4eeiW0xL
Name 5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1,3-dimethyl-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/C20H21N3O2S/c1-12-6-8-16(9-7-12)23-13(2)10-15(14(23)3)11-17-18(24)21(4)20(26)22(5)19(17)25/h6-11H,1-5H3
InChIKey SFMYUAKECPGLJX-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8033
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: 9686430; UBI_ID: UBI-008036
Temperature 308 °C