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1H-Indole, 4-bromo-3-methyl-7-(phenylmethoxy)-1-(phenylsulfonyl)-
SpectraBase Compound ID I7KUmGHLqxw
InChI InChI=1S/C22H18BrNO3S/c1-16-14-24(28(25,26)18-10-6-3-7-11-18)22-20(13-12-19(23)21(16)22)27-15-17-8-4-2-5-9-17/h2-14H,15H2,1H3
InChIKey OZINMWKABJNWBM-UHFFFAOYSA-N
Mol Weight 456.35 g/mol
Molecular Formula C22H18BrNO3S
Exact Mass 455.019078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPcQcMAobiu
Name 1H-Indole, 4-bromo-3-methyl-7-(phenylmethoxy)-1-(phenylsulfonyl)-
Alternate Name(s) 7-(benzyloxy)-4-bromo-3-methyl-1-(phenylsulfonyl)-1H-indole 7-Benzyloxy-4-buomo-3-methyl-1-phenylsulphonyl-1H-indole benzyl 4-bromo-3-methyl-1-(phenylsulfonyl)-1H-indol-7-yl ether
CAS Registry Number 105805-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18BrNO3S
InChI InChI=1S/C22H18BrNO3S/c1-16-14-24(28(25,26)18-10-6-3-7-11-18)22-20(13-12-19(23)21(16)22)27-15-17-8-4-2-5-9-17/h2-14H,15H2,1H3
InChIKey OZINMWKABJNWBM-UHFFFAOYSA-N
Molecular Weight 456.354 g/mol
SMILES c1(S([n]2c3c(c(Br)ccc3OCc3ccccc3)c(c2)C)(=O)=O)ccccc1
SPLASH splash10-0006-9002200000-ca6510c3ef33ccb36416
Source of Spectrum KC-1988-2495-10
Wiley ID 1389002