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Methyl erythro-2-hydroxy-3-(4-methoxyphenyl)-3-(3-acetylamino-2-thienylthio)propionate
SpectraBase Compound ID 3Zy6zhPCjMI
InChI InChI=1S/C17H19NO5S2/c1-10(19)18-13-8-9-24-17(13)25-15(14(20)16(21)23-3)11-4-6-12(22-2)7-5-11/h4-9,14-15,20H,1-3H3,(H,18,19)/t14-,15-/m0/s1
InChIKey GGYUSPURVGXQDD-GJZGRUSLSA-N
Mol Weight 381.46 g/mol
Molecular Formula C17H19NO5S2
Exact Mass 381.070465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOT6b1wmwR0
Name Methyl erythro-2-hydroxy-3-(4-methoxyphenyl)-3-(3-acetylamino-2-thienylthio)propionate
Comments Less than 3 mono-isotopic peaks
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Formula C17H19NO5S2
InChI InChI=1S/C17H19NO5S2/c1-10(19)18-13-8-9-24-17(13)25-15(14(20)16(21)23-3)11-4-6-12(22-2)7-5-11/h4-9,14-15,20H,1-3H3,(H,18,19)/t14-,15-/m0/s1
InChIKey GGYUSPURVGXQDD-GJZGRUSLSA-N
Molecular Weight 381.461 g/mol
SMILES O[C@@]([C@@](Sc1c(ccs1)NC(=O)C)(c1ccc(cc1)OC)[H])(C(=O)OC)[H]
SPLASH splash10-00di-0900000000-65cfc825de74d539e8fb
Source of Spectrum H1-41-716-13
Synonyms methyl 3-{[3-(acetylamino)-2-thienyl]sulfanyl}-2-hydroxy-3-(4-methoxyphenyl)propanoate
Wiley ID 757215