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6,6-Dibutyl-1-[(4-methylphenyl)sulfonyl]-4-(phenylthio)-1,2,3,6-tetrahydropyridine
SpectraBase Compound ID 7fKFem2zDpS
InChI InChI=1S/C26H35NO2S2/c1-4-6-18-26(19-7-5-2)21-24(30-23-11-9-8-10-12-23)17-20-27(26)31(28,29)25-15-13-22(3)14-16-25/h8-16,21H,4-7,17-20H2,1-3H3
InChIKey IOXVOAYIWYYMFG-UHFFFAOYSA-N
Mol Weight 457.7 g/mol
Molecular Formula C26H35NO2S2
Exact Mass 457.210922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KuIFh09REnB
Name 6,6-Dibutyl-1-[(4-methylphenyl)sulfonyl]-4-(phenylthio)-1,2,3,6-tetrahydropyridine
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Formula C26H35NO2S2
InChI InChI=1S/C26H35NO2S2/c1-4-6-18-26(19-7-5-2)21-24(30-23-11-9-8-10-12-23)17-20-27(26)31(28,29)25-15-13-22(3)14-16-25/h8-16,21H,4-7,17-20H2,1-3H3
InChIKey IOXVOAYIWYYMFG-UHFFFAOYSA-N
Molecular Weight 457.691 g/mol
SMILES C1(N(S(c2ccc(cc2)C)(=O)=O)CCC(=C1)Sc1ccccc1)(CCCC)CCCC
SPLASH splash10-0a4v-9550100000-c4e906076267c4690391
Source of Spectrum SO-0-2457-6
Synonyms 6,6-Dibutyl-1-[(4-methylphenyl)sulfonyl]-1,2,3,6-tetrahydro-4-pyridinyl phenyl sulfide 6,6-Dibutyl-1-[(4-methylphenyl)sulfonyl]-4-(phenylsulfanyl)-1,2,3,6-tetrahydropyridine
Wiley ID 878955