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Methyl 1-(2-benzylsulfonylethyl)-3,5-dimethylindole-2-carboxylate
SpectraBase Compound ID 4lAuBgqdJmb
InChI InChI=1S/C21H23NO4S/c1-15-9-10-19-18(13-15)16(2)20(21(23)26-3)22(19)11-12-27(24,25)14-17-7-5-4-6-8-17/h4-10,13H,11-12,14H2,1-3H3
InChIKey KMVJOZFESKXCLG-UHFFFAOYSA-N
Mol Weight 385.48 g/mol
Molecular Formula C21H23NO4S
Exact Mass 385.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xUws3BZioX
Name Methyl 1-(2-benzylsulfonylethyl)-3,5-dimethylindole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO4S
InChI InChI=1S/C21H23NO4S/c1-15-9-10-19-18(13-15)16(2)20(21(23)26-3)22(19)11-12-27(24,25)14-17-7-5-4-6-8-17/h4-10,13H,11-12,14H2,1-3H3
InChIKey KMVJOZFESKXCLG-UHFFFAOYSA-N
Molecular Weight 385.478 g/mol
SMILES c1([n](c2c(c1C)cc(cc2)C)CCS(=O)(=O)Cc1ccccc1)C(=O)OC
SPLASH splash10-054o-8983000000-6b78fdaa99a569e2ac27
Source of Spectrum K-2002-1685-11
Synonyms 1-(2-benzylsulfonylethyl)-3,5-dimethyl-indole-2-carboxylic acid methyl ester 3,5-Dimethyl-1-[2-(phenylmethyl)sulfonylethyl]-2-indolecarboxylic acid methyl ester Methyl 3,5-dimethyl-1-[2-(phenylmethyl)sulfonylethyl]indole-2-carboxylate
Wiley ID 1612917