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

*Links on SpectraBase are not permalinks.

6-({[6-tert-butyl-3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}carbonyl)-3-cyclohexene-1-carboxylic acid

View entire compound with spectra: 1 NMR

6-({[6-tert-butyl-3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}carbonyl)-3-cyclohexene-1-carboxylic acid
SpectraBase Compound ID EcO1WgIj71d
InChI InChI=1S/C23H31NO5S/c1-5-29-22(28)18-16-11-10-13(23(2,3)4)12-17(16)30-20(18)24-19(25)14-8-6-7-9-15(14)21(26)27/h6-7,13-15H,5,8-12H2,1-4H3,(H,24,25)(H,26,27)
InChIKey FRXLAJHLCSTUGA-UHFFFAOYSA-N
Mol Weight 433.56 g/mol
Molecular Formula C23H31NO5S
Exact Mass 433.192294 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 9FcQlj4r1Xf
Name 6-({[6-tert-butyl-3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}carbonyl)-3-cyclohexene-1-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/C23H31NO5S/c1-5-29-22(28)18-16-11-10-13(23(2,3)4)12-17(16)30-20(18)24-19(25)14-8-6-7-9-15(14)21(26)27/h6-7,13-15H,5,8-12H2,1-4H3,(H,24,25)(H,26,27)
InChIKey FRXLAJHLCSTUGA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9873
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/9061364; UBI_ID: UBI-009876
Temperature 313 °C