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Ethyl 1-phenylsulfonyl-3-indole-glyoxylate
SpectraBase Compound ID L2baMAQTuUQ
InChI InChI=1S/C18H15NO5S/c1-2-24-18(21)17(20)15-12-19(16-11-7-6-10-14(15)16)25(22,23)13-8-4-3-5-9-13/h3-12H,2H2,1H3
InChIKey GEJQBHWBFGHOIB-UHFFFAOYSA-N
Mol Weight 357.38 g/mol
Molecular Formula C18H15NO5S
Exact Mass 357.067094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFUdMHZ3f5W
Name 2-(1-besylindol-3-yl)-2-keto-acetic acid ethyl ester
CAS Registry Number 116325-16-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO5S
InChI InChI=1S/C18H15NO5S/c1-2-24-18(21)17(20)15-12-19(16-11-7-6-10-14(15)16)25(22,23)13-8-4-3-5-9-13/h3-12H,2H2,1H3
InChIKey GEJQBHWBFGHOIB-UHFFFAOYSA-N
Molecular Weight 357.380 g/mol
SMILES c1(S([n]2cc(C(C(=O)OCC)=O)c3c2cccc3)(=O)=O)ccccc1
SPLASH splash10-003r-6390000000-8d28d96d09de1a45c601
Source of Spectrum C-110-7192-13
Synonyms 2-[1-(benzenesulfonyl)-3-indolyl]-2-oxoacetic acid ethyl ester Ethyl 2-oxidanylidene-2-[1-(phenylsulfonyl)indol-3-yl]ethanoate Ethyl 2-[1-(benzenesulfonyl)indol-3-yl]-2-oxo-acetate
Wiley ID 1346391