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4R,5S)-5-(4-Methylsulfanyl-phenyl)-2-phenyl-4-p-tolylsulfanylmethyl-4,5-dihydro-oxazole

View entire compound with spectra: 1 MS (GC)

4R,5S)-5-(4-Methylsulfanyl-phenyl)-2-phenyl-4-p-tolylsulfanylmethyl-4,5-dihydro-oxazole
SpectraBase Compound ID 1VW3xDhncMf
InChI InChI=1S/C24H23NOS2/c1-17-8-12-21(13-9-17)28-16-22-23(18-10-14-20(27-2)15-11-18)26-24(25-22)19-6-4-3-5-7-19/h3-15,22-23H,16H2,1-2H3/t22-,23-/m0/s1
InChIKey NDTGNITYAXGPMS-GOTSBHOMSA-N
Mol Weight 405.57 g/mol
Molecular Formula C24H23NOS2
Exact Mass 405.122107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2JgpRM98pE
Name 4R,5S)-5-(4-Methylsulfanyl-phenyl)-2-phenyl-4-p-tolylsulfanylmethyl-4,5-dihydro-oxazole
Alternate Name(s) (4R,5S)-4-{[(4-methylphenyl)sulfanyl]methyl}-5-[4-(methylsulfanyl)phenyl]-2-phenyl-4,5-dihydro-1,3-oxazole (4S,5S)-5-[4-(Methylthio)phenyl]-2-phenyl-4-tolylthiomethyl-2-oxazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23NOS2
InChI InChI=1S/C24H23NOS2/c1-17-8-12-21(13-9-17)28-16-22-23(18-10-14-20(27-2)15-11-18)26-24(25-22)19-6-4-3-5-7-19/h3-15,22-23H,16H2,1-2H3/t22-,23-/m0/s1
InChIKey NDTGNITYAXGPMS-GOTSBHOMSA-N
Molecular Weight 405.574 g/mol
SMILES C1(=N[C@]([C@@](O1)(c1ccc(cc1)SC)[H])(CSc1ccc(cc1)C)[H])c1ccccc1
SPLASH splash10-067i-2911000000-29f28cdde48626bcf45a
Source of Spectrum KD-15-3294-24
Wiley ID 1637233