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1-(benzenesulfonyl)-3-[(1E)-3-methylbuta-1,3-dienyl]indole
SpectraBase Compound ID 6nMIy8x7Yce
InChI InChI=1S/C19H17NO2S/c1-15(2)12-13-16-14-20(19-11-7-6-10-18(16)19)23(21,22)17-8-4-3-5-9-17/h3-14H,1H2,2H3/b13-12+
InChIKey BIXQGKPDMQDJQS-OUKQBFOZSA-N
Mol Weight 323.41 g/mol
Molecular Formula C19H17NO2S
Exact Mass 323.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 275EJgjdsIf
Name 1-(benzenesulfonyl)-3-[(1E)-3-methylbuta-1,3-dienyl]indole
CAS Registry Number 114906-98-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17NO2S
InChI InChI=1S/C19H17NO2S/c1-15(2)12-13-16-14-20(19-11-7-6-10-18(16)19)23(21,22)17-8-4-3-5-9-17/h3-14H,1H2,2H3/b13-12+
InChIKey BIXQGKPDMQDJQS-OUKQBFOZSA-N
Molecular Weight 323.410 g/mol
SMILES c1[n](S(=O)(=O)c2ccccc2)c2c(c1\C=C\C(=C)C)cccc2
SPLASH splash10-003r-2901000000-02fb0f13ceb0735e9e90
Source of Spectrum J-53-3175-2
Synonyms 1-besyl-3-[(1E)-3-methylbuta-1,3-dienyl]indole 3-[(1E)-3-methylbuta-1,3-dienyl]-1-(phenylsulfonyl)indole
Wiley ID 1322479