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3-(4-Methylphenyl)-3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid ethyl ester
SpectraBase Compound ID 4fbv48Ray5c
InChI InChI=1S/C22H29NO4S/c1-7-27-21(24)13-20(19-10-8-14(2)9-11-19)23-28(25,26)22-17(5)15(3)12-16(4)18(22)6/h8-12,20,23H,7,13H2,1-6H3
InChIKey IWXGLEASQJVRGU-UHFFFAOYSA-N
Mol Weight 403.54 g/mol
Molecular Formula C22H29NO4S
Exact Mass 403.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbguFussWur
Name 3-(4-Methylphenyl)-3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid ethyl ester
Alternate Name(s) 3-(p-tolyl)-3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propionic acid ethyl ester Ethyl 3-(4-methylphenyl)-3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Ethyl 3-(p-tolyl)-3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate
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Formula C22H29NO4S
InChI InChI=1S/C22H29NO4S/c1-7-27-21(24)13-20(19-10-8-14(2)9-11-19)23-28(25,26)22-17(5)15(3)12-16(4)18(22)6/h8-12,20,23H,7,13H2,1-6H3
InChIKey IWXGLEASQJVRGU-UHFFFAOYSA-N
Molecular Weight 403.537 g/mol
SMILES N(S(c1c(c(C)cc(c1C)C)C)(=O)=O)C(CC(=O)OCC)c1ccc(cc1)C
SPLASH splash10-067i-4920000000-96dcda6a3d7c5ff0252d
Wiley ID 1465179