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Ethyl 2-methyl-6-(4-(phenylsulfonamido)phenyl)nicotinate
SpectraBase Compound ID 7LkDh6IfeZs
InChI InChI=1S/C21H20N2O4S/c1-3-27-21(24)19-13-14-20(22-15(19)2)16-9-11-17(12-10-16)23-28(25,26)18-7-5-4-6-8-18/h4-14,23H,3H2,1-2H3
InChIKey HLXLFRUTVMDMOO-UHFFFAOYSA-N
Mol Weight 396.46 g/mol
Molecular Formula C21H20N2O4S
Exact Mass 396.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72pBo88WDRe
Name Ethyl 2-methyl-6-(4-(phenylsulfonamido)phenyl)nicotinate
Appearance Pale yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O4S
InChI InChI=1S/C21H20N2O4S/c1-3-27-21(24)19-13-14-20(22-15(19)2)16-9-11-17(12-10-16)23-28(25,26)18-7-5-4-6-8-18/h4-14,23H,3H2,1-2H3
InChIKey HLXLFRUTVMDMOO-UHFFFAOYSA-N
Instrument Name Kratos MS
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3849
Molecular Weight 396.461 g/mol
SMILES N(c1ccc(-c2ccc(C(=O)OCC)c(n2)C)cc1)S(c1ccccc1)(=O)=O
SPLASH splash10-0006-9000000000-175c2e0750705e1ef362
Source of Spectrum Y-57-1131-12a
Wiley ID 1860061