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3-Phenylsulfonyl-1-(3-phthalimidopropyl)indole
SpectraBase Compound ID BRl0buNCJOG
InChI InChI=1S/C25H20N2O4S/c28-24-19-11-4-5-12-20(19)25(29)27(24)16-8-15-26-17-23(21-13-6-7-14-22(21)26)32(30,31)18-9-2-1-3-10-18/h1-7,9-14,17H,8,15-16H2
InChIKey XXFXFXQYKZSFER-UHFFFAOYSA-N
Mol Weight 444.51 g/mol
Molecular Formula C25H20N2O4S
Exact Mass 444.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G88RZpiAWsZ
Name 3-Phenylsulfonyl-1-(3-phthalimidopropyl)indole
Alternate Name(s) 2-(3-(3-(phenylsulfonyl)-1H-indol-1-yl)propyl)isoindoline-1,3-dione 2-[3-[3-(benzenesulfonyl)-1-indolyl]propyl]isoindole-1,3-dione 2-[3-[3-(benzenesulfonyl)indol-1-yl]propyl]isoindole-1,3-dione 2-[3-[3-(benzenesulfonyl)indol-1-yl]propyl]isoindoline-1,3-dione 2-[3-[3-(phenylsulfonyl)indol-1-yl]propyl]isoindole-1,3-dione
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Formula C25H20N2O4S
InChI InChI=1S/C25H20N2O4S/c28-24-19-11-4-5-12-20(19)25(29)27(24)16-8-15-26-17-23(21-13-6-7-14-22(21)26)32(30,31)18-9-2-1-3-10-18/h1-7,9-14,17H,8,15-16H2
InChIKey XXFXFXQYKZSFER-UHFFFAOYSA-N
Molecular Weight 444.505 g/mol
SMILES c1(S(=O)(=O)c2ccccc2)c[n](CCCN2C(c3ccccc3C2=O)=O)c2c1cccc2
SPLASH splash10-000x-1910600000-670354eb8c89bf1425c3
Source of Spectrum HC-46-297-5b
Wiley ID 1739001