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Methyl isothiazolidine-3-carboxylate - S-dioxide
SpectraBase Compound ID DHeGOid7Z4a
InChI InChI=1S/C5H9NO4S/c1-10-5(7)4-2-3-11(8,9)6-4/h4,6H,2-3H2,1H3/t4-/m0/s1
InChIKey UETBQZUGBOZWRA-BYPYZUCNSA-N
Mol Weight 179.19 g/mol
Molecular Formula C5H9NO4S
Exact Mass 179.025229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EqeehgrTjRi
Name Methyl isothiazolidine-3-carboxylate - S-dioxide
Alternate Name(s) (3S)-1,1-dioxo-1,2-thiazolidine-3-carboxylic acid methyl ester Methyl (3S)-1,1-dioxo-1,2-thiazolidine-3-carboxylate Methyl (3S)-1,1-bis(oxidanylidene)-1,2-thiazolidine-3-carboxylate
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Formula C5H9NO4S
InChI InChI=1S/C5H9NO4S/c1-10-5(7)4-2-3-11(8,9)6-4/h4,6H,2-3H2,1H3/t4-/m0/s1
InChIKey UETBQZUGBOZWRA-BYPYZUCNSA-N
Molecular Weight 179.190 g/mol
SMILES N1[C@@](CCS1(=O)=O)(C(=O)OC)[H]
SPLASH splash10-05fr-7900000000-c347d10962763ea6a49b
Source of Spectrum D8-326-140-1
Wiley ID 1514684