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{2-bromo-6-chloro-4-[(1Z)-2-cyano-3-(4-ethoxyanilino)-3-oxo-1-propenyl]phenoxy}acetic acid
SpectraBase Compound ID CYzowfpiIEj
InChI InChI=1S/C20H16BrClN2O5/c1-2-28-15-5-3-14(4-6-15)24-20(27)13(10-23)7-12-8-16(21)19(17(22)9-12)29-11-18(25)26/h3-9H,2,11H2,1H3,(H,24,27)(H,25,26)/b13-7-
InChIKey BWHBFUGEELPDJV-QPEQYQDCSA-N
Mol Weight 479.71 g/mol
Molecular Formula C20H16BrClN2O5
Exact Mass 477.993112 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CMYPrV5wLI6
Name {2-bromo-6-chloro-4-[(1Z)-2-cyano-3-(4-ethoxyanilino)-3-oxo-1-propenyl]phenoxy}acetic 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/C20H16BrClN2O5/c1-2-28-15-5-3-14(4-6-15)24-20(27)13(10-23)7-12-8-16(21)19(17(22)9-12)29-11-18(25)26/h3-9H,2,11H2,1H3,(H,24,27)(H,25,26)/b13-7-
InChIKey BWHBFUGEELPDJV-QPEQYQDCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2653
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/1008369; Labnumber: ARF2832; UZI_ID: UZI-002655
Synonyms {2-bromo-6-chloro-4-[2-cyano-3-(4-ethoxyanilino)-3-oxo-1-propenyl]phenoxy}acetic acid
Temperature 318 °C