{2-bromo-4-[(1E)-3-(3-bromoanilino)-2-cyano-3-oxo-1-propenyl]phenoxy}acetic acid

SpectraBase Compound ID	GoOWdrBZt5T
InChI	InChI=1S/C18H12Br2N2O4/c19-13-2-1-3-14(8-13)22-18(25)12(9-21)6-11-4-5-16(15(20)7-11)26-10-17(23)24/h1-8H,10H2,(H,22,25)(H,23,24)/b12-6+
InChIKey	XBNBALBHQJZKPG-WUXMJOGZSA-N Google Search
Mol Weight	480.11 g/mol
Molecular Formula	C18H12Br2N2O4
Exact Mass	477.916383 g/mol

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SpectraBase Spectrum ID	JAZ5QhvdFOq
Name	{2-bromo-4-[(1E)-3-(3-bromoanilino)-2-cyano-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/C18H12Br2N2O4/c19-13-2-1-3-14(8-13)22-18(25)12(9-21)6-11-4-5-16(15(20)7-11)26-10-17(23)24/h1-8H,10H2,(H,22,25)(H,23,24)/b12-6+
InChIKey	XBNBALBHQJZKPG-WUXMJOGZSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_11849
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: 1003175; UBI_ID: UBI-011852
Synonyms	{2-bromo-4-[3-(3-bromoanilino)-2-cyano-3-oxo-1-propenyl]phenoxy}acetic acid
Temperature	318 °C