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5-(1-tosylindol-3-yl)-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID ZGSGSse7cU
InChI InChI=1S/C25H28N2O4S/c1-18-11-13-20(14-12-18)32(29,30)27-17-22(21-9-5-6-10-23(21)27)19-8-7-15-26(16-19)24(28)31-25(2,3)4/h5-6,9-14,16-17H,7-8,15H2,1-4H3
InChIKey ZGDCEAWWLDDMLY-UHFFFAOYSA-N
Mol Weight 452.57 g/mol
Molecular Formula C25H28N2O4S
Exact Mass 452.176979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAzkmeRISl
Name 5-(1-tosylindol-3-yl)-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester
Alternate Name(s) 5-[1-(4-methylphenyl)sulfonyl-3-indolyl]-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester tert-Butyl 5-[1-(4-methylphenyl)sulfonylindol-3-yl]-3,4-dihydro-2H-pyridine-1-carboxylate tert-Butyl 5-[1-(p-tolylsulfonyl)indol-3-yl]-3,4-dihydro-2H-pyridine-1-carboxylate
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Formula C25H28N2O4S
InChI InChI=1S/C25H28N2O4S/c1-18-11-13-20(14-12-18)32(29,30)27-17-22(21-9-5-6-10-23(21)27)19-8-7-15-26(16-19)24(28)31-25(2,3)4/h5-6,9-14,16-17H,7-8,15H2,1-4H3
InChIKey ZGDCEAWWLDDMLY-UHFFFAOYSA-N
Molecular Weight 452.569 g/mol
SMILES c1[n](S(c2ccc(cc2)C)(=O)=O)c2c(c1C1=CN(C(OC(C)(C)C)=O)CCC1)cccc2
SPLASH splash10-0007-4691000000-cd97b36a1b2ad3e09778
Source of Spectrum H1-37-1770-15
Wiley ID 755915