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5-{[4-(4-cyclohexylphenyl)-3-(isopropoxycarbonyl)-2-thienyl]amino}-5-oxopentanoic acid
SpectraBase Compound ID LJM6EuNizSg
InChI InChI=1S/C25H31NO5S/c1-16(2)31-25(30)23-20(15-32-24(23)26-21(27)9-6-10-22(28)29)19-13-11-18(12-14-19)17-7-4-3-5-8-17/h11-17H,3-10H2,1-2H3,(H,26,27)(H,28,29)
InChIKey NHQMXIWAPMZEQR-UHFFFAOYSA-N
Mol Weight 457.59 g/mol
Molecular Formula C25H31NO5S
Exact Mass 457.192294 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6eRp1tzLHaS
Name 5-{[4-(4-cyclohexylphenyl)-3-(isopropoxycarbonyl)-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/C25H31NO5S/c1-16(2)31-25(30)23-20(15-32-24(23)26-21(27)9-6-10-22(28)29)19-13-11-18(12-14-19)17-7-4-3-5-8-17/h11-17H,3-10H2,1-2H3,(H,26,27)(H,28,29)
InChIKey NHQMXIWAPMZEQR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20371
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/9258007; Labnumber: U_AM_ACK/042304; UZI_ID: UZI-020379
Temperature 318 °C