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1-Phenylsulfonyl-3-bromomethyl-2-cyanoindole
SpectraBase Compound ID 2RroLDVxRhD
InChI InChI=1S/C16H11BrN2O2S/c17-10-14-13-8-4-5-9-15(13)19(16(14)11-18)22(20,21)12-6-2-1-3-7-12/h1-9H,10H2
InChIKey YLXQMMMZULNQFZ-UHFFFAOYSA-N
Mol Weight 375.24 g/mol
Molecular Formula C16H11BrN2O2S
Exact Mass 373.972462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7gCGvdioOuW
Name 1-Phenylsulfonyl-3-bromomethyl-2-cyanoindole
Alternate Name(s) 3-(bromomethyl)-1-(phenylsulfonyl)-1H-indole-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11BrN2O2S
InChI InChI=1S/C16H11BrN2O2S/c17-10-14-13-8-4-5-9-15(13)19(16(14)11-18)22(20,21)12-6-2-1-3-7-12/h1-9H,10H2
InChIKey YLXQMMMZULNQFZ-UHFFFAOYSA-N
Molecular Weight 375.240 g/mol
SMILES c1([n](c2ccccc2c1CBr)S(=O)(=O)c1ccccc1)C#N
SPLASH splash10-0uec-4921000000-598330198a823bfd6c02
Source of Spectrum F4-0-2417-12
Wiley ID 1620178