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1-Tosyl-3-(1'-benzyl-1',2',5',6'-tetrahydropyridin-3'-yl)indole
SpectraBase Compound ID HvjDGlcNxIW
InChI InChI=1S/C27H26N2O2S/c1-21-13-15-24(16-14-21)32(30,31)29-20-26(25-11-5-6-12-27(25)29)23-10-7-17-28(19-23)18-22-8-3-2-4-9-22/h2-6,8-16,20H,7,17-19H2,1H3
InChIKey GHDBYLGPLZMDSJ-UHFFFAOYSA-N
Mol Weight 442.58 g/mol
Molecular Formula C27H26N2O2S
Exact Mass 442.171499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tBQUwvZXMA
Name 1-Tosyl-3-(1'-benzyl-1',2',5',6'-tetrahydropyridin-3'-yl)indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26N2O2S
InChI InChI=1S/C27H26N2O2S/c1-21-13-15-24(16-14-21)32(30,31)29-20-26(25-11-5-6-12-27(25)29)23-10-7-17-28(19-23)18-22-8-3-2-4-9-22/h2-6,8-16,20H,7,17-19H2,1H3
InChIKey GHDBYLGPLZMDSJ-UHFFFAOYSA-N
Molecular Weight 442.577 g/mol
SMILES c1[n](S(c2ccc(cc2)C)(=O)=O)c2c(c1C=1CN(Cc3ccccc3)CCC1)cccc2
SPLASH splash10-00xu-8829000000-c4a24f047170d7d2e823
Source of Spectrum H1-37-1769-11
Synonyms 3-(1-benzyl-1,2,5,6-tetrahydro-3-pyridinyl)-1-[(4-methylphenyl)sulfonyl]-1H-indole 3-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)-1-(4-methylphenyl)sulfonylindole 3-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)-1-(p-tolylsulfonyl)indole 1-(4-Methylphenyl)sulfonyl-3-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-5-yl]indole
Wiley ID 755919