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(3S,4S)-methyl 3-(4-methoxyphenyl)-4-(4-methylphenylsulfonamido)-5-oxo-5-phenylpentanoate
SpectraBase Compound ID 1dGxq8PzrYL
InChI InChI=1S/C26H27NO6S/c1-18-9-15-22(16-10-18)34(30,31)27-25(26(29)20-7-5-4-6-8-20)23(17-24(28)33-3)19-11-13-21(32-2)14-12-19/h4-16,23,25,27H,17H2,1-3H3/t23-,25-/m0/s1
InChIKey MGYMDPPWOHTNBA-ZCYQVOJMSA-N
Mol Weight 481.56 g/mol
Molecular Formula C26H27NO6S
Exact Mass 481.155909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cfwxl3c82Ty
Name (3S,4S)-methyl 3-(4-methoxyphenyl)-4-(4-methylphenylsulfonamido)-5-oxo-5-phenylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO6S
InChI InChI=1S/C26H27NO6S/c1-18-9-15-22(16-10-18)34(30,31)27-25(26(29)20-7-5-4-6-8-20)23(17-24(28)33-3)19-11-13-21(32-2)14-12-19/h4-16,23,25,27H,17H2,1-3H3/t23-,25-/m0/s1
InChIKey MGYMDPPWOHTNBA-ZCYQVOJMSA-N
Literature Reference DOI 10.1002/adsc.201200987
Molecular Weight 481.563 g/mol
SMILES N([C@](C(=O)c1ccccc1)([C@@](CC(OC)=O)(c1ccc(cc1)OC)[H])[H])S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0006-5819000000-2a2655203f269f7faeeb
Source of Spectrum ASC-355-653/SM11-syn_7c
Wiley ID 1761947