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(E)-Methyl 5,5-diphenyl-6-(3-tosylureido)hex-2-enoate
SpectraBase Compound ID DdVG99tmlfL
InChI InChI=1S/C27H28N2O5S/c1-21-15-17-24(18-16-21)35(32,33)29-26(31)28-20-27(19-9-14-25(30)34-2,22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-18H,19-20H2,1-2H3,(H2,28,29,31)/b14-9+
InChIKey OKJMDAUKZXUQKW-NTEUORMPSA-N
Mol Weight 492.59 g/mol
Molecular Formula C27H28N2O5S
Exact Mass 492.171893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34XhnMCJVI
Name (E)-Methyl 5,5-diphenyl-6-(3-tosylureido)hex-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28N2O5S
InChI InChI=1S/C27H28N2O5S/c1-21-15-17-24(18-16-21)35(32,33)29-26(31)28-20-27(19-9-14-25(30)34-2,22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-18H,19-20H2,1-2H3,(H2,28,29,31)/b14-9+
InChIKey OKJMDAUKZXUQKW-NTEUORMPSA-N
Molecular Weight 492.590 g/mol
SMILES N(C(NS(=O)(=O)c1ccc(cc1)C)=O)CC(c1ccccc1)(c1ccccc1)C\C=C\C(OC)=O
SPLASH splash10-06vj-7905000000-983d416e656426a97f7c
Source of Spectrum CAJ-3-1248/SM4-2c
Wiley ID 1775067