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acetamide, N-(4-methylphenyl)-2-[[2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-
SpectraBase Compound ID DWxhtPz8mYG
InChI InChI=1S/C27H23N3O2S/c1-17-7-11-19(12-8-17)25-29-26-22(15-20-5-3-4-6-23(20)32-26)27(30-25)33-16-24(31)28-21-13-9-18(2)10-14-21/h3-14H,15-16H2,1-2H3,(H,28,31)
InChIKey HEQSCYIBVGVGQD-UHFFFAOYSA-N
Mol Weight 453.56 g/mol
Molecular Formula C27H23N3O2S
Exact Mass 453.151098 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4HyFFkYlOYL
Name acetamide, N-(4-methylphenyl)-2-[[2-(4-methylphenyl)-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 453.151098165 u
Formula C27H23N3O2S
InChI InChI=1S/C27H23N3O2S/c1-17-7-11-19(12-8-17)25-29-26-22(15-20-5-3-4-6-23(20)32-26)27(30-25)33-16-24(31)28-21-13-9-18(2)10-14-21/h3-14H,15-16H2,1-2H3,(H,28,31)
InChIKey HEQSCYIBVGVGQD-UHFFFAOYSA-N
Molecular Weight 453.560 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7056
Solvent DMSO-d6
Source Vendor ID: NMR/13289846