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1H-Indole, 3-(3-methylbutyl)-1-(phenylsulfonyl)-
SpectraBase Compound ID EVqcQpfLPBP
InChI InChI=1S/C19H21NO2S/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/h3-11,14-15H,12-13H2,1-2H3
InChIKey IBJKCSOKUWVIAV-UHFFFAOYSA-N
Mol Weight 327.44 g/mol
Molecular Formula C19H21NO2S
Exact Mass 327.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9vcc94MXnm
Name 1H-Indole, 3-(3-methylbutyl)-1-(phenylsulfonyl)-
Alternate Name(s) 1-(Phenylsulfonyl)-3-isopentylindole 3-isopentyl-1-(phenylsulfonyl)-1H-indole
CAS Registry Number 114906-93-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO2S
InChI InChI=1S/C19H21NO2S/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/h3-11,14-15H,12-13H2,1-2H3
InChIKey IBJKCSOKUWVIAV-UHFFFAOYSA-N
Molecular Weight 327.442 g/mol
SMILES c1[n](S(=O)(=O)c2ccccc2)c2c(c1CCC(C)C)cccc2
SPLASH splash10-00ai-2962000000-21eba7cd387b77a6644f
Source of Spectrum J-53-3175-4
Wiley ID 1325559