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2-[2,4-dioxo-3-(2-oxo-5-phenylpentyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]-N,N-diethylacetamide
SpectraBase Compound ID 6X8KMC9mpQ0
InChI InChI=1S/C22H26N4O4S/c1-3-24(4-2)19(28)15-25-17-11-13-31-20(17)21(29)26(22(25)30)14-18(27)23-12-10-16-8-6-5-7-9-16/h5-9,11,13H,3-4,10,12,14-15H2,1-2H3,(H,23,27)
InChIKey PKGDPSZFGWNFJZ-UHFFFAOYSA-N
Mol Weight 442.53 g/mol
Molecular Formula C22H26N4O4S
Exact Mass 442.167477 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IX00ijxMPXG
Name 2-[2,4-dioxo-3-(2-oxo-5-phenylpentyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]-N,N-diethylacetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.167476503 u
Formula C22H26N4O4S
InChI InChI=1S/C22H26N4O4S/c1-3-24(4-2)19(28)15-25-17-11-13-31-20(17)21(29)26(22(25)30)14-18(27)23-12-10-16-8-6-5-7-9-16/h5-9,11,13H,3-4,10,12,14-15H2,1-2H3,(H,23,27)
InChIKey PKGDPSZFGWNFJZ-UHFFFAOYSA-N
Molecular Weight 442.534 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8289
Solvent DMSO-d6
Source Vendor ID: NMR/13219410