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1-Tosyl-2-(hydroxymethyl)-6-methyl-4-(phenylthio)-1,2,3,6-tetrahydropyridine
SpectraBase Compound ID AQHxy1CmPvo
InChI InChI=1S/C20H23NO3S2/c1-15-8-10-20(11-9-15)26(23,24)21-16(2)12-19(13-17(21)14-22)25-18-6-4-3-5-7-18/h3-12,16-17,22H,13-14H2,1-2H3
InChIKey VXJFXFAHSCWKDT-UHFFFAOYSA-N
Mol Weight 389.53 g/mol
Molecular Formula C20H23NO3S2
Exact Mass 389.111936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K776DnOUofh
Name 1-Tosyl-2-(hydroxymethyl)-6-methyl-4-(phenylthio)-1,2,3,6-tetrahydropyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO3S2
InChI InChI=1S/C20H23NO3S2/c1-15-8-10-20(11-9-15)26(23,24)21-16(2)12-19(13-17(21)14-22)25-18-6-4-3-5-7-18/h3-12,16-17,22H,13-14H2,1-2H3
InChIKey VXJFXFAHSCWKDT-UHFFFAOYSA-N
Molecular Weight 389.528 g/mol
SMILES OCC1N(S(c2ccc(cc2)C)(=O)=O)C(C=C(Sc2ccccc2)C1)C
SPLASH splash10-052o-9420000000-17b3a64265023a0a43e6
Source of Spectrum F-67-5400-18
Wiley ID 1687066