5-bromo-2-{5-[(1Z)-2-cyano-3-(methylamino)-3-oxo-1-propenyl]-2-furyl}benzoic acid

SpectraBase Compound ID	LkoDWDbSgax
InChI	InChI=1S/C16H11BrN2O4/c1-19-15(20)9(8-18)6-11-3-5-14(23-11)12-4-2-10(17)7-13(12)16(21)22/h2-7H,1H3,(H,19,20)(H,21,22)/b9-6-
InChIKey	HCECLSRJYRKBRI-TWGQIWQCSA-N Google Search
Mol Weight	375.18 g/mol
Molecular Formula	C16H11BrN2O4
Exact Mass	373.99022 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	JSyLMDdiCbD
Name	5-bromo-2-{5-[(1Z)-2-cyano-3-(methylamino)-3-oxo-1-propenyl]-2-furyl}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/C16H11BrN2O4/c1-19-15(20)9(8-18)6-11-3-5-14(23-11)12-4-2-10(17)7-13(12)16(21)22/h2-7H,1H3,(H,19,20)(H,21,22)/b9-6-
InChIKey	HCECLSRJYRKBRI-TWGQIWQCSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_15911
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: D08938; Labnumber: MVERET-1289; SBI_ID: SBI-015914
Synonyms	5-bromo-2-{5-[2-cyano-3-(methylamino)-3-oxo-1-propenyl]-2-furyl}benzoic acid
Temperature	308 °C