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Ethyl 3-[Hydroxy(phenyl)methyl]-1-tosylindole-2-carboxylate
SpectraBase Compound ID IZIyAYmD8Bg
InChI InChI=1S/C25H23NO5S/c1-3-31-25(28)23-22(24(27)18-9-5-4-6-10-18)20-11-7-8-12-21(20)26(23)32(29,30)19-15-13-17(2)14-16-19/h4-16,24,27H,3H2,1-2H3
InChIKey VACUEROOTSYDCZ-UHFFFAOYSA-N
Mol Weight 449.52 g/mol
Molecular Formula C25H23NO5S
Exact Mass 449.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WC00nH61dN
Name Ethyl 3-[Hydroxy(phenyl)methyl]-1-tosylindole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23NO5S
InChI InChI=1S/C25H23NO5S/c1-3-31-25(28)23-22(24(27)18-9-5-4-6-10-18)20-11-7-8-12-21(20)26(23)32(29,30)19-15-13-17(2)14-16-19/h4-16,24,27H,3H2,1-2H3
InChIKey VACUEROOTSYDCZ-UHFFFAOYSA-N
Molecular Weight 449.521 g/mol
SMILES OC(c1c([n](S(c2ccc(cc2)C)(=O)=O)c2c1cccc2)C(=O)OCC)c1ccccc1
SPLASH splash10-0005-0090000000-e0e9924dc33fb45e1e6b
Source of Spectrum F4-43-1757-12a
Wiley ID 1675771