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4-Allyl-5-methoxy-1-(hydroxymethyl)-3-(4-toluenesulfonyl)-1H-indole
SpectraBase Compound ID 51lGu8jIQpB
InChI InChI=1S/C20H21NO4S/c1-4-5-16-18(25-3)11-10-17-20(16)19(12-21(17)13-22)26(23,24)15-8-6-14(2)7-9-15/h4,6-12,22H,1,5,13H2,2-3H3
InChIKey FRXLNUDKSJSSGY-UHFFFAOYSA-N
Mol Weight 371.45 g/mol
Molecular Formula C20H21NO4S
Exact Mass 371.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GphmNx879am
Name 4-Allyl-5-methoxy-1-(hydroxymethyl)-3-(4-toluenesulfonyl)-1H-indole
Alternate Name(s) {4-allyl-5-methoxy-3-[(4-methylphenyl)sulfonyl]-1H-indol-1-yl}methanol [5-methoxy-3-(4-methylphenyl)sulfonyl-4-prop-2-enyl-1-indolyl]methanol [5-methoxy-3-(4-methylphenyl)sulfonyl-4-prop-2-enylindol-1-yl]methanol [4-allyl-5-methoxy-3-(p-tolylsulfonyl)indol-1-yl]methanol [5-methoxy-3-(4-methylphenyl)sulfonyl-4-prop-2-enyl-indol-1-yl]methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO4S
InChI InChI=1S/C20H21NO4S/c1-4-5-16-18(25-3)11-10-17-20(16)19(12-21(17)13-22)26(23,24)15-8-6-14(2)7-9-15/h4,6-12,22H,1,5,13H2,2-3H3
InChIKey FRXLNUDKSJSSGY-UHFFFAOYSA-N
Molecular Weight 371.451 g/mol
SMILES OC[n]1cc(S(c2ccc(cc2)C)(=O)=O)c2c1ccc(c2CC=C)OC
SPLASH splash10-000f-0906000000-2050f461eb34d51f6dfe
Source of Spectrum F-53-207-16
Wiley ID 799870