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Ethyl 2-(4,5-dimethoxy-2-ethoxycarbonylaminobenzoyl)methylsulfonylacetate
SpectraBase Compound ID 5pe4ZudMs9K
InChI InChI=1S/C17H23NO9S/c1-6-26-16(20)15(28(5,22)23)14(19)10-8-12(24-3)13(25-4)9-11(10)18-17(21)27-7-2/h8-9,19H,6-7H2,1-5H3,(H,18,21)/b15-14+
InChIKey WIOSKASIPUDNFZ-CCEZHUSRSA-N
Mol Weight 417.43 g/mol
Molecular Formula C17H23NO9S
Exact Mass 417.109352 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nuV7t8mHTA
Name Ethyl 2-(4,5-dimethoxy-2-ethoxycarbonylaminobenzoyl)methylsulfonylacetate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO9S
InChI InChI=1S/C17H23NO9S/c1-6-26-16(20)15(28(5,22)23)14(19)10-8-12(24-3)13(25-4)9-11(10)18-17(21)27-7-2/h8-9,19H,6-7H2,1-5H3,(H,18,21)/b15-14+
InChIKey WIOSKASIPUDNFZ-CCEZHUSRSA-N
Molecular Weight 417.429 g/mol
SMILES N(c1c(\C(=C\(S(=O)(=O)C)C(=O)OCC)O)cc(c(c1)OC)OC)C(=O)OCC
SPLASH splash10-0a4i-0091100000-cf05e49d50144a4c812c
Source of Spectrum H1-51-1556-23
Synonyms (E)-3-(2-Ethoxycarbonylamino-4,5-dimethoxy-phenyl)-3-hydroxy-2-methanesulfonyl-acrylic acid ethyl ester Ethyl[(2-{2-[(ethoxycarbonyl)amino]-4,5-dimethoxyphenyl}-2-oxoethyl)sulfonyl]acetate
Wiley ID 817304