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(4R,5S)-3-(tert-butylsulfanylmethyl)-4-isopropyl-5-phenyl-oxazolidin-2-one
SpectraBase Compound ID 2USKIB9nagz
InChI InChI=1S/C17H25NO2S/c1-12(2)14-15(13-9-7-6-8-10-13)20-16(19)18(14)11-21-17(3,4)5/h6-10,12,14-15H,11H2,1-5H3/t14-,15+/m1/s1
InChIKey XDKRBOWSLOYTOI-CABCVRRESA-N
Mol Weight 307.45 g/mol
Molecular Formula C17H25NO2S
Exact Mass 307.1606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RVnXjCn0MB
Name (4R,5S)-3-(tert-butylsulfanylmethyl)-4-isopropyl-5-phenyl-oxazolidin-2-one
Alternate Name(s) (4R,5S)-3-(tert-butylsulfanylmethyl)-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one (4R,5S)-3-[(tert-butylthio)methyl]-4-isopropyl-5-phenyl-oxazolidin-2-one (4R,5S)-3-[(tert-butylthio)methyl]-5-phenyl-4-propan-2-yl-2-oxazolidinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO2S
InChI InChI=1S/C17H25NO2S/c1-12(2)14-15(13-9-7-6-8-10-13)20-16(19)18(14)11-21-17(3,4)5/h6-10,12,14-15H,11H2,1-5H3/t14-,15+/m1/s1
InChIKey XDKRBOWSLOYTOI-CABCVRRESA-N
Molecular Weight 307.452 g/mol
SMILES C1(N([C@@]([C@@](O1)(c1ccccc1)[H])(C(C)C)[H])CSC(C)(C)C)=O
SPLASH splash10-0006-9000000000-4b706fd0de592a4a29da
Source of Spectrum J-67-3634-9
Wiley ID 1569924