For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-({[3-(aminocarbonyl)-4-(4-tert-butylphenyl)-5-methyl-2-thienyl]amino}carbonyl)bicyclo[2.2.1]heptane-2-carboxylic acid
SpectraBase Compound ID 6MK4Bex2nCg
InChI InChI=1S/C25H30N2O4S/c1-12-17(13-7-9-16(10-8-13)25(2,3)4)20(21(26)28)23(32-12)27-22(29)18-14-5-6-15(11-14)19(18)24(30)31/h7-10,14-15,18-19H,5-6,11H2,1-4H3,(H2,26,28)(H,27,29)(H,30,31)/t14-,15+,18-,19-/m1/s1
InChIKey AUTDOOQJXFNLPJ-WTLGNFPFSA-N
Mol Weight 454.59 g/mol
Molecular Formula C25H30N2O4S
Exact Mass 454.192629 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 54rCsXbUgaV
Name 3-({[3-(aminocarbonyl)-4-(4-tert-butylphenyl)-5-methyl-2-thienyl]amino}carbonyl)bicyclo[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/C25H30N2O4S/c1-12-17(13-7-9-16(10-8-13)25(2,3)4)20(21(26)28)23(32-12)27-22(29)18-14-5-6-15(11-14)19(18)24(30)31/h7-10,14-15,18-19H,5-6,11H2,1-4H3,(H2,26,28)(H,27,29)(H,30,31)/t14-,15+,18-,19-/m1/s1
InChIKey AUTDOOQJXFNLPJ-WTLGNFPFSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_19536
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/9180749; Labnumber: U_AM_ACK/001497; UZI_ID: UZI-019543
Temperature 308 °C