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2-[(2R,3R,4S,5S)-3,4,5-triacetoxytetrahydropyran-2-yl]thiazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID Fg8zOhOK0a3
InChI InChI=1S/C17H21NO9S/c1-5-23-17(22)11-7-28-16(18-11)15-14(27-10(4)21)13(26-9(3)20)12(6-24-15)25-8(2)19/h7,12-15H,5-6H2,1-4H3/t12-,13-,14+,15+/m0/s1
InChIKey KBZMUIVMHNQODW-BYNSBNAKSA-N
Mol Weight 415.41 g/mol
Molecular Formula C17H21NO9S
Exact Mass 415.093702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZC3nKCAID1
Name 2-[(2R,3R,4S,5S)-3,4,5-triacetoxytetrahydropyran-2-yl]thiazole-4-carboxylic acid ethyl ester
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Formula C17H21NO9S
InChI InChI=1S/C17H21NO9S/c1-5-23-17(22)11-7-28-16(18-11)15-14(27-10(4)21)13(26-9(3)20)12(6-24-15)25-8(2)19/h7,12-15H,5-6H2,1-4H3/t12-,13-,14+,15+/m0/s1
InChIKey KBZMUIVMHNQODW-BYNSBNAKSA-N
Molecular Weight 415.413 g/mol
SMILES [C@@]1(c2nc(C(=O)OCC)cs2)([C@@]([C@@](OC(=O)C)([C@](CO1)(OC(=O)C)[H])[H])(OC(=O)C)[H])[H]
SPLASH splash10-000f-9762400000-d2a06d6bdf1ed2893cf4
Source of Spectrum F-47-5543-7
Synonyms 2-[(2R,3R,4S,5S)-3,4,5-triacetyloxy-2-oxanyl]-4-thiazolecarboxylic acid ethyl ester Ethyl 2-[(2R,3R,4S,5S)-3,4,5-triacetoxytetrahydropyran-2-yl]thiazole-4-carboxylate Ethyl 2-[(2R,3R,4S,5S)-3,4,5-triacetyloxyoxan-2-yl]-1,3-thiazole-4-carboxylate
Wiley ID 1375885