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(2E)-2-{3-[(4-chloro-3-methylphenoxy)methyl]-4-methoxybenzylidene}-3,4-dihydro-1(2H)-naphthalenone
SpectraBase Compound ID 8aNo1uXPtL6
InChI InChI=1S/C26H23ClO3/c1-17-13-22(10-11-24(17)27)30-16-21-15-18(7-12-25(21)29-2)14-20-9-8-19-5-3-4-6-23(19)26(20)28/h3-7,10-15H,8-9,16H2,1-2H3/b20-14+
InChIKey QUTXDJNVDXOKAP-XSFVSMFZSA-N
Mol Weight 418.92 g/mol
Molecular Formula C26H23ClO3
Exact Mass 418.133572 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LZUt84Px0E4
Name (2E)-2-{3-[(4-chloro-3-methylphenoxy)methyl]-4-methoxybenzylidene}-3,4-dihydro-1(2H)-naphthalenone
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/C26H23ClO3/c1-17-13-22(10-11-24(17)27)30-16-21-15-18(7-12-25(21)29-2)14-20-9-8-19-5-3-4-6-23(19)26(20)28/h3-7,10-15H,8-9,16H2,1-2H3/b20-14+
InChIKey QUTXDJNVDXOKAP-XSFVSMFZSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26688
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: D63830; Labnumber: KHAN-0439; SBI_ID: SBI-026692
Synonyms 2-{3-[(4-chloro-3-methylphenoxy)methyl]-4-methoxybenzylidene}-3,4-dihydro-1(2H)-naphthalenone
Temperature 315 °C