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4,6(1H,5H)-pyrimidinedione, dihydro-1-phenyl-2-thioxo-5-[(2,3,4-trimethoxyphenyl)methylene]-, (5E)-
SpectraBase Compound ID 65B3NjXdteV
InChI InChI=1S/C20H18N2O5S/c1-25-15-10-9-12(16(26-2)17(15)27-3)11-14-18(23)21-20(28)22(19(14)24)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,21,23,28)/b14-11+
InChIKey HSIYTTYKFYMTCH-SDNWHVSQSA-N
Mol Weight 398.43 g/mol
Molecular Formula C20H18N2O5S
Exact Mass 398.093643 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JFmmabUJ9Yw
Name 4,6(1H,5H)-pyrimidinedione, dihydro-1-phenyl-2-thioxo-5-[(2,3,4-trimethoxyphenyl)methylene]-, (5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.093642857 u
Formula C20H18N2O5S
InChI InChI=1S/C20H18N2O5S/c1-25-15-10-9-12(16(26-2)17(15)27-3)11-14-18(23)21-20(28)22(19(14)24)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,21,23,28)/b14-11+
InChIKey HSIYTTYKFYMTCH-SDNWHVSQSA-N
Molecular Weight 398.433 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6469
Solvent DMSO-d6
Source Vendor ID: NMR/9253451; Lab Info: LP; Lab Number: LP-0020066