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1-(1,3-Benzodioxol-5-yl)-3-(3,4-dichlorophenyl)-2-propen-1-one
SpectraBase Compound ID EycLO5EieOf
InChI InChI=1S/C16H10Cl2O3/c17-12-4-1-10(7-13(12)18)2-5-14(19)11-3-6-15-16(8-11)21-9-20-15/h1-8H,9H2/b5-2+
InChIKey KSMNIYKXKSRXHJ-GORDUTHDSA-N
Mol Weight 321.16 g/mol
Molecular Formula C16H10Cl2O3
Exact Mass 320.0007 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HLwmtKMtRj8
Name 2-propen-1-one, 1-(1,3-benzodioxol-5-yl)-3-(3,4-dichlorophenyl)-, (2E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.000699579 u
Formula C16H10Cl2O3
InChI InChI=1S/C16H10Cl2O3/c17-12-4-1-10(7-13(12)18)2-5-14(19)11-3-6-15-16(8-11)21-9-20-15/h1-8H,9H2/b5-2+
InChIKey KSMNIYKXKSRXHJ-GORDUTHDSA-N
Molecular Weight 321.159 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10198
Solvent DMSO-d6
Source Vendor ID: NMR/10241463; Lab Info: LP; Lab Number: LP-0103025