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2-Phenyl-7-(toluene-4-sulphonyl)-6,7-dihydro-5H-[1]pyridine
SpectraBase Compound ID Ch5xkXghRiG
InChI InChI=1S/C21H19NO2S/c1-15-7-11-18(12-8-15)25(23,24)20-14-10-17-9-13-19(22-21(17)20)16-5-3-2-4-6-16/h2-9,11-13,20H,10,14H2,1H3
InChIKey BYOXQDFHLWWMQD-UHFFFAOYSA-N
Mol Weight 349.45 g/mol
Molecular Formula C21H19NO2S
Exact Mass 349.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6mRPivhVcX2
Name 2-Phenyl-7-(toluene-4-sulphonyl)-6,7-dihydro-5H-[1]pyridine
Alternate Name(s) 2-Phenyl-7-(p-tolylsulfonyl)-6,7-dihydro-5H-cyclopenta[b]pyridine 7-(4-Methylphenyl)sulfonyl-2-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridine
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Formula C21H19NO2S
InChI InChI=1S/C21H19NO2S/c1-15-7-11-18(12-8-15)25(23,24)20-14-10-17-9-13-19(22-21(17)20)16-5-3-2-4-6-16/h2-9,11-13,20H,10,14H2,1H3
InChIKey BYOXQDFHLWWMQD-UHFFFAOYSA-N
Molecular Weight 349.448 g/mol
SMILES C1(S(c2ccc(cc2)C)(=O)=O)c2nc(-c3ccccc3)ccc2CC1
SPLASH splash10-0006-0910000000-bb8ad6e8b099cd241861
Source of Spectrum E2-50-466-15
Wiley ID 1555854