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3-(octane-1-sulfinyl)propanoic acid

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3-(octane-1-sulfinyl)propanoic acid
SpectraBase Compound ID 1VzmgvJSTql
InChI InChI=1S/C11H22O3S/c1-2-3-4-5-6-7-9-15(14)10-8-11(12)13/h2-10H2,1H3,(H,12,13)
InChIKey XVNOLOWZGLUMGU-UHFFFAOYSA-N
Mol Weight 234.35 g/mol
Molecular Formula C11H22O3S
Exact Mass 234.128966 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FiaVAdIK1rn
Name propanoic acid, 3-(octylsulfinyl)-
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/C11H22O3S/c1-2-3-4-5-6-7-9-15(14)10-8-11(12)13/h2-10H2,1H3,(H,12,13)
InChIKey XVNOLOWZGLUMGU-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_7523
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: ZERO/001471; IOH_ID: IOH-014527
Temperature 303 °C