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5-{[3-(ethoxycarbonyl)-4-(4-isobutylphenyl)-5-methyl-2-thienyl]amino}-5-oxopentanoic acid
SpectraBase Compound ID J8cEShIeJD4
InChI InChI=1S/C23H29NO5S/c1-5-29-23(28)21-20(17-11-9-16(10-12-17)13-14(2)3)15(4)30-22(21)24-18(25)7-6-8-19(26)27/h9-12,14H,5-8,13H2,1-4H3,(H,24,25)(H,26,27)
InChIKey QMVOCKYRQOZSJB-UHFFFAOYSA-N
Mol Weight 431.55 g/mol
Molecular Formula C23H29NO5S
Exact Mass 431.176644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 962ebb70e8f
Name 5-{[3-(ethoxycarbonyl)-4-(4-isobutylphenyl)-5-methyl-2-thienyl]amino}-5-oxopentanoic acid
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/C23H29NO5S/c1-5-29-23(28)21-20(17-11-9-16(10-12-17)13-14(2)3)15(4)30-22(21)24-18(25)7-6-8-19(26)27/h9-12,14H,5-8,13H2,1-4H3,(H,24,25)(H,26,27)
InChIKey QMVOCKYRQOZSJB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15155
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/9125514; Labnumber: NSB-0096242; UZI_ID: UZI-015159
Temperature 318 °C