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benzoic acid, 4-[[(tetrahydro-1,3-dimethyl-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)methyl]amino]-, 2-(diethylamino)ethyl ester

View entire compound with spectra: 1 NMR

benzoic acid, 4-[[(tetrahydro-1,3-dimethyl-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)methyl]amino]-, 2-(diethylamino)ethyl ester
SpectraBase Compound ID xyD3UAzPuR
InChI InChI=1S/C20H26N4O4S/c1-5-24(6-2)11-12-28-19(27)14-7-9-15(10-8-14)21-13-16-17(25)22(3)20(29)23(4)18(16)26/h7-10,13,21H,5-6,11-12H2,1-4H3
InChIKey RXNHXLIWFBVSEA-UHFFFAOYSA-N
Mol Weight 418.51 g/mol
Molecular Formula C20H26N4O4S
Exact Mass 418.167477 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DvQ8R8C0KpP
Name benzoic acid, 4-[[(tetrahydro-1,3-dimethyl-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)methyl]amino]-, 2-(diethylamino)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 418.167476503 u
Formula C20H26N4O4S
InChI InChI=1S/C20H26N4O4S/c1-5-24(6-2)11-12-28-19(27)14-7-9-15(10-8-14)21-13-16-17(25)22(3)20(29)23(4)18(16)26/h7-10,13,21H,5-6,11-12H2,1-4H3
InChIKey RXNHXLIWFBVSEA-UHFFFAOYSA-N
Molecular Weight 418.512 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17783
Solvent DMSO-d6
Source Vendor ID: NMR/11270653; Lab Info: LP; Lab Number: LP-1701216