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

*Links on SpectraBase are not permalinks.
4-({4-bromo-2-[(E)-(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzoic acid
SpectraBase Compound ID JGB2nZwmhqh
InChI InChI=1S/C19H14BrNO5S/c1-21-17(22)16(27-19(21)25)9-13-8-14(20)6-7-15(13)26-10-11-2-4-12(5-3-11)18(23)24/h2-9H,10H2,1H3,(H,23,24)/b16-9+
InChIKey STJAYPYSOWZXFW-CXUHLZMHSA-N
Mol Weight 448.29 g/mol
Molecular Formula C19H14BrNO5S
Exact Mass 446.977607 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 DDmpuU0rWdJ
Name 4-({4-bromo-2-[(E)-(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzoic 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/C19H14BrNO5S/c1-21-17(22)16(27-19(21)25)9-13-8-14(20)6-7-15(13)26-10-11-2-4-12(5-3-11)18(23)24/h2-9H,10H2,1H3,(H,23,24)/b16-9+
InChIKey STJAYPYSOWZXFW-CXUHLZMHSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14094
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/1010795; UBI_ID: UBI-014097
Synonyms 4-({4-bromo-2-[(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzoic acid
Temperature 315 °C