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2-(1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)-N-(2-phenylethyl)acetamide
SpectraBase Compound ID GTKji9IJSqs
InChI InChI=1S/C22H25N3O4S/c1-22(2,3)17(26)13-24-16-10-12-30-19(16)20(28)25(21(24)29)14-18(27)23-11-9-15-7-5-4-6-8-15/h4-8,10,12H,9,11,13-14H2,1-3H3,(H,23,27)
InChIKey PHKOBNXOFGJXSF-UHFFFAOYSA-N
Mol Weight 427.52 g/mol
Molecular Formula C22H25N3O4S
Exact Mass 427.156577 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 85QsFZZYHOI
Name 2-(1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)-N-(2-phenylethyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 427.156577467 u
Formula C22H25N3O4S
InChI InChI=1S/C22H25N3O4S/c1-22(2,3)17(26)13-24-16-10-12-30-19(16)20(28)25(21(24)29)14-18(27)23-11-9-15-7-5-4-6-8-15/h4-8,10,12H,9,11,13-14H2,1-3H3,(H,23,27)
InChIKey PHKOBNXOFGJXSF-UHFFFAOYSA-N
Molecular Weight 427.519 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8286
Solvent DMSO-d6
Source Vendor ID: NMR/13219406