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5-pyrimidinecarboxylic acid, 4-(2,4-dichlorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-thioxo-, ethyl ester
SpectraBase Compound ID G5kEghz5dAb
InChI InChI=1S/C14H14Cl2N2O2S/c1-3-20-13(19)11-7(2)17-14(21)18-12(11)9-5-4-8(15)6-10(9)16/h4-6,12H,3H2,1-2H3,(H2,17,18,21)
InChIKey VCHVYIOMTSEAFL-UHFFFAOYSA-N
Mol Weight 345.24 g/mol
Molecular Formula C14H14Cl2N2O2S
Exact Mass 344.015304 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cq8mrZ7uiAP
Name 5-pyrimidinecarboxylic acid, 4-(2,4-dichlorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-thioxo-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.015304271 u
Formula C14H14Cl2N2O2S
InChI InChI=1S/C14H14Cl2N2O2S/c1-3-20-13(19)11-7(2)17-14(21)18-12(11)9-5-4-8(15)6-10(9)16/h4-6,12H,3H2,1-2H3,(H2,17,18,21)
InChIKey VCHVYIOMTSEAFL-UHFFFAOYSA-N
Molecular Weight 345.244 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2009
Solvent DMSO-d6
Source Vendor ID: ZI/6039597; Lab Info: LP; Lab Number: LP-04/281
Temperature 29.85 °C