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3-({[3-(aminocarbonyl)-4-(4-isopropylphenyl)-5-methyl-2-thienyl]amino}carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

View entire compound with spectra: 1 NMR

3-({[3-(aminocarbonyl)-4-(4-isopropylphenyl)-5-methyl-2-thienyl]amino}carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
SpectraBase Compound ID F8IIyvfXTjQ
InChI InChI=1S/C23H26N2O5S/c1-10(2)12-4-6-13(7-5-12)16-11(3)31-22(19(16)20(24)26)25-21(27)17-14-8-9-15(30-14)18(17)23(28)29/h4-7,10,14-15,17-18H,8-9H2,1-3H3,(H2,24,26)(H,25,27)(H,28,29)/t14-,15+,17+,18+/m0/s1
InChIKey UEFMHVVECHMYPR-BURFUSLBSA-N
Mol Weight 442.53 g/mol
Molecular Formula C23H26N2O5S
Exact Mass 442.156243 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LWFIDpRIToU
Name 3-({[3-(aminocarbonyl)-4-(4-isopropylphenyl)-5-methyl-2-thienyl]amino}carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic 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/C23H26N2O5S/c1-10(2)12-4-6-13(7-5-12)16-11(3)31-22(19(16)20(24)26)25-21(27)17-14-8-9-15(30-14)18(17)23(28)29/h4-7,10,14-15,17-18H,8-9H2,1-3H3,(H2,24,26)(H,25,27)(H,28,29)/t14-,15+,17+,18+/m0/s1
InChIKey UEFMHVVECHMYPR-BURFUSLBSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15667
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/1003651; Labnumber: NSB-0099635; UZI_ID: UZI-015671
Temperature 308 °C