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(2E,6E)-2,6-bis{[5-(3,4-dichlorophenyl)-2-furyl]methylene}-4-methylcyclohexanone
SpectraBase Compound ID 30DLPjX8CiT
InChI InChI=1S/C29H20Cl4O3/c1-16-10-19(12-21-4-8-27(35-21)17-2-6-23(30)25(32)14-17)29(34)20(11-16)13-22-5-9-28(36-22)18-3-7-24(31)26(33)15-18/h2-9,12-16H,10-11H2,1H3/b19-12+,20-13+
InChIKey LLRIOIKHJAIFDL-KVOOEGMKSA-N
Mol Weight 558.3 g/mol
Molecular Formula C29H20Cl4O3
Exact Mass 556.016655 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7jgTW75bbrP
Name (2E,6E)-2,6-bis{[5-(3,4-dichlorophenyl)-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/C29H20Cl4O3/c1-16-10-19(12-21-4-8-27(35-21)17-2-6-23(30)25(32)14-17)29(34)20(11-16)13-22-5-9-28(36-22)18-3-7-24(31)26(33)15-18/h2-9,12-16H,10-11H2,1H3/b19-12+,20-13+
InChIKey LLRIOIKHJAIFDL-KVOOEGMKSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14715
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: C26015; Labnumber: MAT3-0047; SBI_ID: SBI-014718
Synonyms 2,6-bis{[5-(3,4-dichlorophenyl)-2-furyl]methylene}-4-methylcyclohexanone
Temperature 318 °C