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acetamide, 2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-nitrophenyl)-6-oxo-2-pyridinyl]thio]-N-(2,4-dimethylphenyl)-
SpectraBase Compound ID HjSBAkZUOMF
InChI InChI=1S/C22H20N4O4S/c1-13-3-8-19(14(2)9-13)24-21(28)12-31-22-18(11-23)17(10-20(27)25-22)15-4-6-16(7-5-15)26(29)30/h3-9,17H,10,12H2,1-2H3,(H,24,28)(H,25,27)
InChIKey GCBVNILXHUQTTF-UHFFFAOYSA-N
Mol Weight 436.49 g/mol
Molecular Formula C22H20N4O4S
Exact Mass 436.120526 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2ntyshHj3G9
Name acetamide, 2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-nitrophenyl)-6-oxo-2-pyridinyl]thio]-N-(2,4-dimethylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.120526310 u
Formula C22H20N4O4S
InChI InChI=1S/C22H20N4O4S/c1-13-3-8-19(14(2)9-13)24-21(28)12-31-22-18(11-23)17(10-20(27)25-22)15-4-6-16(7-5-15)26(29)30/h3-9,17H,10,12H2,1-2H3,(H,24,28)(H,25,27)
InChIKey GCBVNILXHUQTTF-UHFFFAOYSA-N
Molecular Weight 436.486 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9002
Solvent DMSO-d6
Source Vendor ID: NMR/9264785; Lab Info: KR; Lab Number: KR-0000022