(2E,6E)-2,6-bis{[5-(4-chloro-3-nitrophenyl)-2-furyl]methylene}-4-methylcyclohexanone

SpectraBase Compound ID	4Fe59cvPEs1
InChI	InChI=1S/C29H20Cl2N2O7/c1-16-10-19(12-21-4-8-27(39-21)17-2-6-23(30)25(14-17)32(35)36)29(34)20(11-16)13-22-5-9-28(40-22)18-3-7-24(31)26(15-18)33(37)38/h2-9,12-16H,10-11H2,1H3/b19-12+,20-13+
InChIKey	VVFZDNIHJOJHEY-KVOOEGMKSA-N Google Search
Mol Weight	579.39 g/mol
Molecular Formula	C29H20Cl2N2O7
Exact Mass	578.064756 g/mol

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SpectraBase Spectrum ID	AMerc01rg0S
Name	(2E,6E)-2,6-bis{[5-(4-chloro-3-nitrophenyl)-2-furyl]methylene}-4-methylcyclohexanone
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/C29H20Cl2N2O7/c1-16-10-19(12-21-4-8-27(39-21)17-2-6-23(30)25(14-17)32(35)36)29(34)20(11-16)13-22-5-9-28(40-22)18-3-7-24(31)26(15-18)33(37)38/h2-9,12-16H,10-11H2,1H3/b19-12+,20-13+
InChIKey	VVFZDNIHJOJHEY-KVOOEGMKSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_14716
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: C26016; Labnumber: MAT3-0048; SBI_ID: SBI-014719
Synonyms	2,6-bis{[5-(4-chloro-3-nitrophenyl)-2-furyl]methylene}-4-methylcyclohexanone
Temperature	318 °C