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

*Links on SpectraBase are not permalinks.
benzoic acid, 2,4-dichloro-, 2-bromo-6-ethoxy-4-(1-piperidinylcarbonothioyl)phenyl ester
SpectraBase Compound ID LvY5ZsOOuKo
InChI InChI=1S/C21H20BrCl2NO3S/c1-2-27-18-11-13(20(29)25-8-4-3-5-9-25)10-16(22)19(18)28-21(26)15-7-6-14(23)12-17(15)24/h6-7,10-12H,2-5,8-9H2,1H3
InChIKey DBTRXRHIBUGNEH-UHFFFAOYSA-N
Mol Weight 517.27 g/mol
Molecular Formula C21H20BrCl2NO3S
Exact Mass 514.972433 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 F7F6GB0TWNf
Name benzoic acid, 2,4-dichloro-, 2-bromo-6-ethoxy-4-(1-piperidinylcarbonothioyl)phenyl ester
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/C21H20BrCl2NO3S/c1-2-27-18-11-13(20(29)25-8-4-3-5-9-25)10-16(22)19(18)28-21(26)15-7-6-14(23)12-17(15)24/h6-7,10-12H,2-5,8-9H2,1H3
InChIKey DBTRXRHIBUGNEH-UHFFFAOYSA-N
NMR Offset 16.1752
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_CB_8313_2354
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: NMR/9253330; Labnumber: LD-0500004
Temperature 313 °C