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3-(methylthio)propionic acid, ethyl ester

View entire compound with spectra: 3 NMR, 6 FTIR, and 12 MS (GC)

3-(methylthio)propionic acid, ethyl ester
SpectraBase Compound ID EHrxEbv1nVF
InChI InChI=1S/C6H12O2S/c1-3-8-6(7)4-5-9-2/h3-5H2,1-2H3
InChIKey YSNWHRKJEKWJNY-UHFFFAOYSA-N
Mol Weight 148.22 g/mol
Molecular Formula C6H12O2S
Exact Mass 148.055801 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8aaNG3uQVkK
Name Ethyl 3-(methylthio)propionate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number W334308
CAS Registry Number 13327-56-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O2S
InChI InChI=1S/C6H12O2S/c1-3-8-6(7)4-5-9-2/h3-5H2,1-2H3
InChIKey YSNWHRKJEKWJNY-UHFFFAOYSA-N
Observed nucleus 1H
Purity >=99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_013063