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3-Propoxycarbonylmethylthiopropionic acid, methyl ester
SpectraBase Compound ID 9AwBzzj7GIw
InChI InChI=1S/C9H16O4S/c1-3-5-13-9(11)7-14-6-4-8(10)12-2/h3-7H2,1-2H3
InChIKey SNFJIISHTHERRD-UHFFFAOYSA-N
Mol Weight 220.28 g/mol
Molecular Formula C9H16O4S
Exact Mass 220.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2BVkzXxROi
Name 3-Propoxycarbonylmethylthiopropionic acid, methyl ester
Alternate Name(s) 3-[(2-keto-2-propoxy-ethyl)thio]propionic acid methyl ester 3-[(2-oxo-2-propoxyethyl)thio]propanoic acid methyl ester Methyl 3-(2-oxidanylidene-2-propoxy-ethyl)sulfanylpropanoate Methyl 3-(2-oxo-2-propoxy-ethyl)sulfanylpropanoate
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Formula C9H16O4S
InChI InChI=1S/C9H16O4S/c1-3-5-13-9(11)7-14-6-4-8(10)12-2/h3-7H2,1-2H3
InChIKey SNFJIISHTHERRD-UHFFFAOYSA-N
Molecular Weight 220.283 g/mol
SMILES C(CCSCC(=O)OCCC)(=O)OC
SPLASH splash10-03dj-9400000000-d2c4273ea9803e6377b5
Wiley ID 1486011