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3-(4-Ethoxy-3-methoxy-phenyl)-3-(p-tolylsulfonylamino)propanoic acid
SpectraBase Compound ID Ero2WJIUpOf
InChI InChI=1S/C19H23NO6S/c1-4-26-17-10-7-14(11-18(17)25-3)16(12-19(21)22)20-27(23,24)15-8-5-13(2)6-9-15/h5-11,16,20H,4,12H2,1-3H3,(H,21,22)
InChIKey QLRQXDZZOUKNCI-UHFFFAOYSA-N
Mol Weight 393.45 g/mol
Molecular Formula C19H23NO6S
Exact Mass 393.124609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zmvi3AxHbV
Name 3-(4-Ethoxy-3-methoxy-phenyl)-3-(p-tolylsulfonylamino)propanoic acid
Alternate Name(s) 3-(4-Ethoxy-3-methoxy-phenyl)-3-(tosylamino)propionic acid 3-(4-Ethoxy-3-methoxy-phenyl)-3-[(4-methylphenyl)sulfonylamino]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO6S
InChI InChI=1S/C19H23NO6S/c1-4-26-17-10-7-14(11-18(17)25-3)16(12-19(21)22)20-27(23,24)15-8-5-13(2)6-9-15/h5-11,16,20H,4,12H2,1-3H3,(H,21,22)
InChIKey QLRQXDZZOUKNCI-UHFFFAOYSA-N
Molecular Weight 393.454 g/mol
SMILES N(S(c1ccc(C)cc1)(=O)=O)C(CC(=O)O)c1cc(OC)c(cc1)OCC
SPLASH splash10-0006-6920000000-c761f2a0b6d8bb3f2172
Wiley ID 1443163