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(5E)-1-(4-Chlorophenyl)-5-(1H-pyrrol-2-ylmethylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

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(5E)-1-(4-Chlorophenyl)-5-(1H-pyrrol-2-ylmethylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID G6OSJD9UwST
InChI InChI=1S/C15H10ClN3O2S/c16-9-3-5-11(6-4-9)19-14(21)12(13(20)18-15(19)22)8-10-2-1-7-17-10/h1-8,17H,(H,18,20,22)/b12-8+
InChIKey TZIACVAYKVLEBG-XYOKQWHBSA-N
Mol Weight 331.78 g/mol
Molecular Formula C15H10ClN3O2S
Exact Mass 331.018225 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HNt7knNm2Zg
Name 4,6(1H,5H)-pyrimidinedione, 1-(4-chlorophenyl)dihydro-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-, (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 331.018225446 u
Formula C15H10ClN3O2S
InChI InChI=1S/C15H10ClN3O2S/c16-9-3-5-11(6-4-9)19-14(21)12(13(20)18-15(19)22)8-10-2-1-7-17-10/h1-8,17H,(H,18,20,22)/b12-8+
InChIKey TZIACVAYKVLEBG-XYOKQWHBSA-N
Molecular Weight 331.777 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9192
Solvent DMSO-d6
Source Vendor ID: NMR/9253492; Lab Info: LP; Lab Number: LP-0020149