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acetamide, 2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-2-pyridinyl]thio]-N-(2-methylphenyl)-
SpectraBase Compound ID EQsuVTd9WmL
InChI InChI=1S/C22H21N3O4S/c1-13-5-3-4-6-17(13)24-21(28)12-30-22-16(11-23)15(10-20(27)25-22)14-7-8-18(26)19(9-14)29-2/h3-9,15,26H,10,12H2,1-2H3,(H,24,28)(H,25,27)
InChIKey ACQANESRNJDMRM-UHFFFAOYSA-N
Mol Weight 423.49 g/mol
Molecular Formula C22H21N3O4S
Exact Mass 423.125277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ANcvRwmOZrR
Name acetamide, 2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-2-pyridinyl]thio]-N-(2-methylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.125277338 u
Formula C22H21N3O4S
InChI InChI=1S/C22H21N3O4S/c1-13-5-3-4-6-17(13)24-21(28)12-30-22-16(11-23)15(10-20(27)25-22)14-7-8-18(26)19(9-14)29-2/h3-9,15,26H,10,12H2,1-2H3,(H,24,28)(H,25,27)
InChIKey ACQANESRNJDMRM-UHFFFAOYSA-N
Molecular Weight 423.487 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6618
Solvent DMSO-d6
Source Vendor ID: NMR/9264770; Lab Info: KR; Lab Number: KR-0000007