(2E)-3-(1,3-benzodioxol-5-yl)-2-[(2-bromobenzoyl)amino]-2-propenoic acid

SpectraBase Compound ID	AZxfGfrQaKV
InChI	InChI=1S/C17H12BrNO5/c18-12-4-2-1-3-11(12)16(20)19-13(17(21)22)7-10-5-6-14-15(8-10)24-9-23-14/h1-8H,9H2,(H,19,20)(H,21,22)/b13-7+
InChIKey	KARCWJIHYZRGEU-NTUHNPAUSA-N Google Search
Mol Weight	390.19 g/mol
Molecular Formula	C17H12BrNO5
Exact Mass	388.989885 g/mol

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SpectraBase Spectrum ID	CkJ2OEdGC8e
Name	(2E)-3-(1,3-benzodioxol-5-yl)-2-[(2-bromobenzoyl)amino]-2-propenoic acid
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C17H12BrNO5/c18-12-4-2-1-3-11(12)16(20)19-13(17(21)22)7-10-5-6-14-15(8-10)24-9-23-14/h1-8H,9H2,(H,19,20)(H,21,22)/b13-7+
InChIKey	KARCWJIHYZRGEU-NTUHNPAUSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_11260
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: 802426; Labnumber: AEGU8-1660; VK_ID: VK-011264
Synonyms	3-(1,3-benzodioxol-5-yl)-2-[(2-bromobenzoyl)amino]-2-propenoic acid
Temperature	308 °C