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acetamide, N-(3,4-dimethylphenyl)-2-[[2-[4-(methylthio)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-
SpectraBase Compound ID HFTPqoIzXSs
InChI InChI=1S/C28H25N3O2S2/c1-17-8-11-21(14-18(17)2)29-25(32)16-35-28-23-15-20-6-4-5-7-24(20)33-27(23)30-26(31-28)19-9-12-22(34-3)13-10-19/h4-14H,15-16H2,1-3H3,(H,29,32)
InChIKey OSZZGOHRADZJBE-UHFFFAOYSA-N
Mol Weight 499.65 g/mol
Molecular Formula C28H25N3O2S2
Exact Mass 499.138819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L3hju6PE30
Name acetamide, N-(3,4-dimethylphenyl)-2-[[2-[4-(methylthio)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 499.138819403 u
Formula C28H25N3O2S2
InChI InChI=1S/C28H25N3O2S2/c1-17-8-11-21(14-18(17)2)29-25(32)16-35-28-23-15-20-6-4-5-7-24(20)33-27(23)30-26(31-28)19-9-12-22(34-3)13-10-19/h4-14H,15-16H2,1-3H3,(H,29,32)
InChIKey OSZZGOHRADZJBE-UHFFFAOYSA-N
Molecular Weight 499.647 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7059
Solvent DMSO-d6
Source Vendor ID: NMR/13289850