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2-{[1-(4-ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]sulfanyl}-5-ethyl-4,6-dimethylnicotinonitrile
SpectraBase Compound ID 48IVFiM5TA3
InChI InChI=1S/C22H23N3O3S/c1-5-17-13(3)18(12-23)21(24-14(17)4)29-19-11-20(26)25(22(19)27)15-7-9-16(10-8-15)28-6-2/h7-10,19H,5-6,11H2,1-4H3
InChIKey BMOJAIUTMXLPGF-UHFFFAOYSA-N
Mol Weight 409.5 g/mol
Molecular Formula C22H23N3O3S
Exact Mass 409.146013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DuiPOnmBmFw
Name 2-{[1-(4-ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]sulfanyl}-5-ethyl-4,6-dimethylnicotinonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H23N3O3S/c1-5-17-13(3)18(12-23)21(24-14(17)4)29-19-11-20(26)25(22(19)27)15-7-9-16(10-8-15)28-6-2/h7-10,19H,5-6,11H2,1-4H3
InChIKey BMOJAIUTMXLPGF-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12536
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9122886; UBI_ID: UBI-012539
Temperature 313 °C