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Ethyl 1-phenylsulfonyl-2-phenylsulfinylmethylindole-3-carboxylate
SpectraBase Compound ID EM0c0Iy47QE
InChI InChI=1S/C24H21NO5S2/c1-2-30-24(26)23-20-15-9-10-16-21(20)25(32(28,29)19-13-7-4-8-14-19)22(23)17-31(27)18-11-5-3-6-12-18/h3-16H,2,17H2,1H3
InChIKey JUHBEJTZZZAOOA-UHFFFAOYSA-N
Mol Weight 467.55 g/mol
Molecular Formula C24H21NO5S2
Exact Mass 467.086115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GY0rUCsSjfi
Name Ethyl 1-phenylsulfonyl-2-phenylsulfinylmethylindole-3-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C24H21NO5S2
InChI InChI=1S/C24H21NO5S2/c1-2-30-24(26)23-20-15-9-10-16-21(20)25(32(28,29)19-13-7-4-8-14-19)22(23)17-31(27)18-11-5-3-6-12-18/h3-16H,2,17H2,1H3
InChIKey JUHBEJTZZZAOOA-UHFFFAOYSA-N
Molecular Weight 467.554 g/mol
SMILES c1([n](c2c(c1C(=O)OCC)cccc2)S(=O)(=O)c1ccccc1)CS(=O)c1ccccc1
SPLASH splash10-0xr0-0009900000-4f16408b597edb352d23
Source of Spectrum F-65-3597-4b
Synonyms 2-(benzenesulfinylmethyl)-1-(benzenesulfonyl)-3-indolecarboxylic acid ethyl ester ethyl 2-(benzenesulfinylmethyl)-1-(benzenesulfonyl)indole-3-carboxylate ethyl 2-(phenylsulfinylmethyl)-1-(phenylsulfonyl)indole-3-carboxylate
Wiley ID 1680617