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4-{[4-(4-cyclohexylphenyl)-3-(isopropoxycarbonyl)-2-thienyl]amino}-4-oxobutanoic acid
SpectraBase Compound ID 2YghWm6H3hj
InChI InChI=1S/C24H29NO5S/c1-15(2)30-24(29)22-19(14-31-23(22)25-20(26)12-13-21(27)28)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h8-11,14-16H,3-7,12-13H2,1-2H3,(H,25,26)(H,27,28)
InChIKey XCEHGTVVCGMLMY-UHFFFAOYSA-N
Mol Weight 443.56 g/mol
Molecular Formula C24H29NO5S
Exact Mass 443.176644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID MH7zu5e2mc
Name 4-{[4-(4-cyclohexylphenyl)-3-(isopropoxycarbonyl)-2-thienyl]amino}-4-oxobutanoic 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/C24H29NO5S/c1-15(2)30-24(29)22-19(14-31-23(22)25-20(26)12-13-21(27)28)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h8-11,14-16H,3-7,12-13H2,1-2H3,(H,25,26)(H,27,28)
InChIKey XCEHGTVVCGMLMY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20370
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/9245476; Labnumber: U_AM_ACK/042303; UZI_ID: UZI-020378
Temperature 318 °C