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

*Links on SpectraBase are not permalinks.
isopropyl 2-[(2-chloro-5-nitrobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID Io6TpeNbfeQ
InChI InChI=1S/C20H21ClN2O5S/c1-10(2)28-20(25)17-13-6-4-11(3)8-16(13)29-19(17)22-18(24)14-9-12(23(26)27)5-7-15(14)21/h5,7,9-11H,4,6,8H2,1-3H3,(H,22,24)
InChIKey DFERTMZINQFADT-UHFFFAOYSA-N
Mol Weight 436.91 g/mol
Molecular Formula C20H21ClN2O5S
Exact Mass 436.085971 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 33DWhTILNrW
Name isopropyl 2-[(2-chloro-5-nitrobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C20H21ClN2O5S/c1-10(2)28-20(25)17-13-6-4-11(3)8-16(13)29-19(17)22-18(24)14-9-12(23(26)27)5-7-15(14)21/h5,7,9-11H,4,6,8H2,1-3H3,(H,22,24)
InChIKey DFERTMZINQFADT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3693
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/8103224; UBI_ID: UBI-003694
Temperature 308 °C