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(4S,5S)-5-[4-(Methylthio)phenyl]-2-phenyl-4-thiomethoxymethyl-2-oxazoline
SpectraBase Compound ID AEmO112WLm8
InChI InChI=1S/C18H19NOS2/c1-21-12-16-17(13-8-10-15(22-2)11-9-13)20-18(19-16)14-6-4-3-5-7-14/h3-11,16-17H,12H2,1-2H3/t16-,17-/m0/s1
InChIKey OCZGNSHYZATBKO-IRXDYDNUSA-N
Mol Weight 329.48 g/mol
Molecular Formula C18H19NOS2
Exact Mass 329.090807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDPj46i36KJ
Name (4S,5S)-5-[4-(Methylthio)phenyl]-2-phenyl-4-thiomethoxymethyl-2-oxazoline
Alternate Name(s) (4R,5S)-4-[(methylsulfanyl)methyl]-5-[4-(methylsulfanyl)phenyl]-2-phenyl-4,5-dihydro-1,3-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NOS2
InChI InChI=1S/C18H19NOS2/c1-21-12-16-17(13-8-10-15(22-2)11-9-13)20-18(19-16)14-6-4-3-5-7-14/h3-11,16-17H,12H2,1-2H3/t16-,17-/m0/s1
InChIKey OCZGNSHYZATBKO-IRXDYDNUSA-N
Molecular Weight 329.476 g/mol
SMILES C1(=N[C@]([C@@](O1)(c1ccc(cc1)SC)[H])(CSC)[H])c1ccccc1
SPLASH splash10-067i-3930000000-e0fcd5c6c3621ea5e228
Source of Spectrum KD-15-3295-23
Wiley ID 1637231