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5-Methoxy-1-tosyl-3-(1'-benzyl-1',2',5',6'-tetrahydropyridin-3'-yl)indole
SpectraBase Compound ID GclNlorU5MF
InChI InChI=1S/C28H28N2O3S/c1-21-10-13-25(14-11-21)34(31,32)30-20-27(26-17-24(33-2)12-15-28(26)30)23-9-6-16-29(19-23)18-22-7-4-3-5-8-22/h3-5,7-15,17,20H,6,16,18-19H2,1-2H3
InChIKey HEOZTCUWDJIZJL-UHFFFAOYSA-N
Mol Weight 472.6 g/mol
Molecular Formula C28H28N2O3S
Exact Mass 472.182064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3IOlvs9HfM
Name 5-Methoxy-1-tosyl-3-(1'-benzyl-1',2',5',6'-tetrahydropyridin-3'-yl)indole
Alternate Name(s) 3-(1-benzyl-1,2,5,6-tetrahydro-3-pyridinyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-5-yl methyl ether 3-(1-benzyl-1,2,5,6-tetrahydro-3-pyridinyl)-5-methoxy-1-[(4-methylphenyl)sulfonyl]-1H-indole
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Formula C28H28N2O3S
InChI InChI=1S/C28H28N2O3S/c1-21-10-13-25(14-11-21)34(31,32)30-20-27(26-17-24(33-2)12-15-28(26)30)23-9-6-16-29(19-23)18-22-7-4-3-5-8-22/h3-5,7-15,17,20H,6,16,18-19H2,1-2H3
InChIKey HEOZTCUWDJIZJL-UHFFFAOYSA-N
Molecular Weight 472.603 g/mol
SMILES c1[n](S(c2ccc(cc2)C)(=O)=O)c2c(c1C=1CN(Cc3ccccc3)CCC1)cc(cc2)OC
SPLASH splash10-0f6x-7409000000-a5ae5ccb0fa63171360c
Source of Spectrum H1-37-1770-13
Wiley ID 755917