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(2R,3S)-3-hydroxy-2-thianecarboxylic acid ethyl ester
SpectraBase Compound ID 6JIhOtqqXRV
InChI InChI=1S/C8H14O3S/c1-2-11-8(10)7-6(9)4-3-5-12-7/h6-7,9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKey FHUNONPZVJTAOO-NKWVEPMBSA-N
Mol Weight 190.26 g/mol
Molecular Formula C8H14O3S
Exact Mass 190.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3qqK6DKfXd
Name (2R,3S)-3-hydroxy-2-thianecarboxylic acid ethyl ester
Alternate Name(s) (2R,3S)-3-hydroxytetrahydrothiopyran-2-carboxylic acid ethyl ester Ethyl (2R,3S)-3-hydroxytetrahydrothiopyran-2-carboxylate Ethyl (2R,3S)-3-hydroxythiane-2-carboxylate Ethyl (2R,3S)-3-oxidanylthiane-2-carboxylate
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Formula C8H14O3S
InChI InChI=1S/C8H14O3S/c1-2-11-8(10)7-6(9)4-3-5-12-7/h6-7,9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKey FHUNONPZVJTAOO-NKWVEPMBSA-N
Molecular Weight 190.257 g/mol
SMILES O[C@@]1([C@@](SCCC1)(C(=O)OCC)[H])[H]
SPLASH splash10-006x-3900000000-8a70a78e03b68ab4c8a9
Source of Spectrum K-2001-2617-40
Wiley ID 1579775