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4-Imidazolidinone, 1-benzoyl-2-(1,1-dimethylethyl)-3-methyl-5-(1-methylethyl)-5-[2-(methylthio)ethyl]-, (2S-trans)-
SpectraBase Compound ID CVzCOB0HbXA
InChI InChI=1S/C21H32N2O2S/c1-15(2)21(13-14-26-7)19(25)22(6)18(20(3,4)5)23(21)17(24)16-11-9-8-10-12-16/h8-12,15,18H,13-14H2,1-7H3/t18-,21-/m0/s1
InChIKey BOWWJHBSPSONFB-RXVVDRJESA-N
Mol Weight 376.6 g/mol
Molecular Formula C21H32N2O2S
Exact Mass 376.218449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8LLBx51dH5k
Name 4-Imidazolidinone, 1-benzoyl-2-(1,1-dimethylethyl)-3-methyl-5-(1-methylethyl)-5-[2-(methylthio)ethyl]-, (2S-trans)-
CAS Registry Number 109918-55-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32N2O2S
InChI InChI=1S/C21H32N2O2S/c1-15(2)21(13-14-26-7)19(25)22(6)18(20(3,4)5)23(21)17(24)16-11-9-8-10-12-16/h8-12,15,18H,13-14H2,1-7H3/t18-,21-/m0/s1
InChIKey BOWWJHBSPSONFB-RXVVDRJESA-N
Molecular Weight 376.559 g/mol
SMILES [C@@]1(N([C@](N(C1=O)C)(C(C)(C)C)[H])C(=O)c1ccccc1)(C(C)C)CCSC
SPLASH splash10-0aor-6907000000-dc84e50044a46dcfbdb7
Source of Spectrum H-69-1374-15
Synonyms (2S,5S)-1-Benzoyl-2-(tert-butyl)-3-methyl-5-isopropyl-5-(3'-thiabutyl)imidazolidin-4-on (2S,5S)-1-benzoyl-2-tert-butyl-5-isopropyl-3-methyl-5-[2-(methylsulfanyl)ethyl]-4-imidazolidinone
Wiley ID 1357777