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4-Allyl-5-methoxy-1-methanesulfonyl-3-(4-toluenesulfonyl)-1H-indole
SpectraBase Compound ID ENvPzLW164b
InChI InChI=1S/C20H21NO5S2/c1-5-6-16-18(26-3)12-11-17-20(16)19(13-21(17)27(4,22)23)28(24,25)15-9-7-14(2)8-10-15/h5,7-13H,1,6H2,2-4H3
InChIKey KWCXZOXNUIVUAN-UHFFFAOYSA-N
Mol Weight 419.51 g/mol
Molecular Formula C20H21NO5S2
Exact Mass 419.086115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5aL3MePcALm
Name 4-Allyl-5-methoxy-1-methanesulfonyl-3-(4-toluenesulfonyl)-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO5S2
InChI InChI=1S/C20H21NO5S2/c1-5-6-16-18(26-3)12-11-17-20(16)19(13-21(17)27(4,22)23)28(24,25)15-9-7-14(2)8-10-15/h5,7-13H,1,6H2,2-4H3
InChIKey KWCXZOXNUIVUAN-UHFFFAOYSA-N
Molecular Weight 419.510 g/mol
SMILES c1(S(c2ccc(cc2)C)(=O)=O)c2c(ccc(c2CC=C)OC)[n](c1)S(=O)(=O)C
SPLASH splash10-00ri-0942600000-0462a40abf82ab2dd32a
Source of Spectrum F-53-207-18
Synonyms 4-Allyl-5-methoxy-1-(methylsulfonyl)-1H-indol-3-yl 4-methylphenyl sulfone 4-Allyl-5-methoxy-3-[(4-methylphenyl)sulfonyl]-1-(methylsulfonyl)-1H-indole 5-Methoxy-3-(4-methylphenyl)sulfonyl-1-methylsulfonyl-4-prop-2-enylindole 4-Allyl-5-methoxy-1-methylsulfonyl-3-(p-tolylsulfonyl)indole 5-Methoxy-3-(4-methylphenyl)sulfonyl-1-methylsulfonyl-4-prop-2-enyl-indole
Wiley ID 799868