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Methyl 3-[(2-methoxy-2-oxoethyl)thio]propionate
SpectraBase Compound ID KYHqWaiFZxU
InChI InChI=1S/C7H12O4S/c1-10-6(8)3-4-12-5-7(9)11-2/h3-5H2,1-2H3
InChIKey XNDKLLFGXIEGKL-UHFFFAOYSA-N
Mol Weight 192.23 g/mol
Molecular Formula C7H12O4S
Exact Mass 192.04563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2Om29W3QR4
Name 3-[(2-keto-2-methoxy-ethyl)thio]propionic acid methyl ester
CAS Registry Number 7400-45-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O4S
InChI InChI=1S/C7H12O4S/c1-10-6(8)3-4-12-5-7(9)11-2/h3-5H2,1-2H3
InChIKey XNDKLLFGXIEGKL-UHFFFAOYSA-N
Molecular Weight 192.229 g/mol
SMILES C(CCSCC(=O)OC)(=O)OC
SPLASH splash10-03ec-0900000000-5cad8de6ab177824443a
Source of Spectrum F-47-4857-23
Synonyms 3-[(2-methoxy-2-oxoethyl)thio]propanoic acid methyl ester Dimethyl 3-thiaadipate Methyl 3-(2-methoxy-2-oxidanylidene-ethyl)sulfanylpropanoate Methyl 3-(2-methoxy-2-oxo-ethyl)sulfanylpropanoate Methyl 3-(methoxycarbonylmethylthio)propionate Propanoic acid, 3-(((methoxycarbonyl)methyl)thio)-, methyl ester Propanoic acid, 3-(carbomethoxymethylthio)-, methyl ester Propanoic acid, 3-[(2-methoxy-2-oxoethyl)thio]-, methyl ester
Wiley ID 1187908