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benzoic acid, 2-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-
SpectraBase Compound ID JqMbZv4uyjL
InChI InChI=1S/C17H16O3S/c1-2-12-7-9-13(10-8-12)15(18)11-21-16-6-4-3-5-14(16)17(19)20/h3-10H,2,11H2,1H3,(H,19,20)
InChIKey PTHNBNXHWCFLHA-UHFFFAOYSA-N
Mol Weight 300.37 g/mol
Molecular Formula C17H16O3S
Exact Mass 300.082016 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IrxnaUcgP1
Name benzoic acid, 2-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-
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/C17H16O3S/c1-2-12-7-9-13(10-8-12)15(18)11-21-16-6-4-3-5-14(16)17(19)20/h3-10H,2,11H2,1H3,(H,19,20)
InChIKey PTHNBNXHWCFLHA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7958
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: NMR/11211119; Labnumber: 0488