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5-{[1-(3-chloro-4-methylphenyl)-1H-pyrrol-2-yl]methylene}-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID LD9BmJsRJVB
InChI InChI=1S/C18H16ClN3O3/c1-11-6-7-13(10-15(11)19)22-8-4-5-12(22)9-14-16(23)20(2)18(25)21(3)17(14)24/h4-10H,1-3H3
InChIKey DFBDGRBDWVDTLG-UHFFFAOYSA-N
Mol Weight 357.8 g/mol
Molecular Formula C18H16ClN3O3
Exact Mass 357.088019 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6LEsnpIe5fM
Name 5-{[1-(3-chloro-4-methylphenyl)-1H-pyrrol-2-yl]methylene}-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 357.088019084 u
Formula C18H16ClN3O3
InChI InChI=1S/C18H16ClN3O3/c1-11-6-7-13(10-15(11)19)22-8-4-5-12(22)9-14-16(23)20(2)18(25)21(3)17(14)24/h4-10H,1-3H3
InChIKey DFBDGRBDWVDTLG-UHFFFAOYSA-N
Molecular Weight 357.797 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1043
Solvent DMSO-d6
Source Vendor ID: NMR/12269137