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2-Thiophenecarboxylic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-3-[(methylsulfonyl)oxy]-, ethyl ester
SpectraBase Compound ID A0ijbICow3q
InChI InChI=1S/C13H19NO7S2/c1-6-19-11(15)10-9(21-23(5,17)18)8(7-22-10)14-12(16)20-13(2,3)4/h7H,6H2,1-5H3,(H,14,16)
InChIKey UTYVJWUPRJOASQ-UHFFFAOYSA-N
Mol Weight 365.42 g/mol
Molecular Formula C13H19NO7S2
Exact Mass 365.060294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Nv1aaF6zNO
Name 2-Thiophenecarboxylic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-3-[(methylsulfonyl)oxy]-, ethyl ester
Alternate Name(s) 2-Ethoxycarbonyl-4((tert-butoxycarbonyl)amino)-thiophenyl-2-methanesulfanate Ethyl 4-[(tert-butoxycarbonyl)amino]-3-[(methylsulfonyl)oxy]-2-thiophenecarboxylate
CAS Registry Number 96846-44-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO7S2
InChI InChI=1S/C13H19NO7S2/c1-6-19-11(15)10-9(21-23(5,17)18)8(7-22-10)14-12(16)20-13(2,3)4/h7H,6H2,1-5H3,(H,14,16)
InChIKey UTYVJWUPRJOASQ-UHFFFAOYSA-N
Molecular Weight 365.415 g/mol
SMILES N(C(OC(C)(C)C)=O)c1c(c(sc1)C(=O)OCC)OS(=O)(=O)C
SPLASH splash10-0a4i-9400000000-1408052365fc36f25fe0
Source of Spectrum J-50-2734-10
Wiley ID 1351264