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(2S,5R)-1-benzoyl-2-tert-butyl-3,5-dimethyl-5-(2-methylsulfanylethyl)imidazolidin-4-one
SpectraBase Compound ID KIcwM5OYx93
InChI InChI=1S/C19H28N2O2S/c1-18(2,3)16-20(5)17(23)19(4,12-13-24-6)21(16)15(22)14-10-8-7-9-11-14/h7-11,16H,12-13H2,1-6H3/t16-,19+/m0/s1
InChIKey HXZPQLFIXHEDSE-QFBILLFUSA-N
Mol Weight 348.51 g/mol
Molecular Formula C19H28N2O2S
Exact Mass 348.187149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GEzXVcTu6QZ
Name (2S,5R)-1-benzoyl-2-tert-butyl-3,5-dimethyl-5-(2-methylsulfanylethyl)imidazolidin-4-one
CAS Registry Number 98262-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28N2O2S
InChI InChI=1S/C19H28N2O2S/c1-18(2,3)16-20(5)17(23)19(4,12-13-24-6)21(16)15(22)14-10-8-7-9-11-14/h7-11,16H,12-13H2,1-6H3/t16-,19+/m0/s1
InChIKey HXZPQLFIXHEDSE-QFBILLFUSA-N
Molecular Weight 348.505 g/mol
SMILES [C@@]1(N([C@@](C(N1C)=O)(CCSC)C)C(=O)c1ccccc1)(C(C)(C)C)[H]
SPLASH splash10-054o-6970000000-fa52ffe536a78d4d2de4
Source of Spectrum H-69-1374-15
Synonyms (2S,5R)-1-benzoyl-2-tert-butyl-3,5-dimethyl-5-[2-(methylthio)ethyl]-4-imidazolidinone (2S,5R)-2-tert-butyl-3,5-dimethyl-5-(2-methylsulfanylethyl)-1-(phenylcarbonyl)imidazolidin-4-one
Wiley ID 1340606