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1H-Indole-3-carbonitrile, 2-(4-chlorobenzenesulfonylmethyl)-1-methyl-
SpectraBase Compound ID 55H7DLEmk2D
InChI InChI=1S/C17H13ClN2O2S/c1-20-16-5-3-2-4-14(16)15(10-19)17(20)11-23(21,22)13-8-6-12(18)7-9-13/h2-9H,11H2,1H3
InChIKey NTRAJWMXRMDBEJ-UHFFFAOYSA-N
Mol Weight 344.82 g/mol
Molecular Formula C17H13ClN2O2S
Exact Mass 344.038627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LL0eludvfoY
Name 1H-Indole-3-carbonitrile, 2-(4-chlorobenzenesulfonylmethyl)-1-methyl-
Alternate Name(s) 2-[(4-chlorophenyl)sulfonylmethyl]-1-methyl-3-indolecarbonitrile 2-[(4-chlorophenyl)sulfonylmethyl]-1-methyl-indole-3-carbonitrile 2-{[(4-chlorophenyl)sulfonyl]methyl}-1-methyl-1H-indole-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13ClN2O2S
InChI InChI=1S/C17H13ClN2O2S/c1-20-16-5-3-2-4-14(16)15(10-19)17(20)11-23(21,22)13-8-6-12(18)7-9-13/h2-9H,11H2,1H3
InChIKey NTRAJWMXRMDBEJ-UHFFFAOYSA-N
Molecular Weight 344.816 g/mol
SMILES c1(c(c2ccccc2[n]1C)C#N)CS(c1ccc(cc1)Cl)(=O)=O
SPLASH splash10-014i-1900000000-6aeca7f73894990015a6
Wiley ID 1441233