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(4R,5S)-5-[4-(Methylthio)phenyl]-2-phenyl-4-thioacetoxymethyl-2-oxazoline
SpectraBase Compound ID JG8BVRLvq09
InChI InChI=1S/C19H19NO2S2/c1-13(21)24-12-17-18(14-8-10-16(23-2)11-9-14)22-19(20-17)15-6-4-3-5-7-15/h3-11,17-18H,12H2,1-2H3/t17-,18-/m0/s1
InChIKey DTAPFWGHUGBTFQ-ROUUACIJSA-N
Mol Weight 357.49 g/mol
Molecular Formula C19H19NO2S2
Exact Mass 357.085721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aze9JtSO93x
Name (4R,5S)-5-[4-(Methylthio)phenyl]-2-phenyl-4-thioacetoxymethyl-2-oxazoline
Alternate Name(s) (4S,5S)-5-[4-(Methylthio)phenyl]-2-phenyl-4-thioacetoxymethyl-2-oxazoline S-({(4R,5S)-5-[4-(methylsulfanyl)phenyl]-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl}methyl) ethanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO2S2
InChI InChI=1S/C19H19NO2S2/c1-13(21)24-12-17-18(14-8-10-16(23-2)11-9-14)22-19(20-17)15-6-4-3-5-7-15/h3-11,17-18H,12H2,1-2H3/t17-,18-/m0/s1
InChIKey DTAPFWGHUGBTFQ-ROUUACIJSA-N
Molecular Weight 357.486 g/mol
SMILES C1(=N[C@]([C@@](O1)(c1ccc(cc1)SC)[H])(CSC(=O)C)[H])c1ccccc1
SPLASH splash10-02ai-2920000000-7eb7f5600a7ab3e9f97b
Source of Spectrum KD-15-3294-13
Wiley ID 1637232