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5-Benzyl-2-t-butyl-3-methyl-4-oxoimidazolidine-1-carboxylic acid, t-butyl ester
SpectraBase Compound ID KXXsLB4A9YA
InChI InChI=1S/C20H30N2O3/c1-19(2,3)17-21(7)16(23)15(13-14-11-9-8-10-12-14)22(17)18(24)25-20(4,5)6/h8-12,15,17H,13H2,1-7H3
InChIKey METIHFSTMAPWHP-UHFFFAOYSA-N
Mol Weight 346.47 g/mol
Molecular Formula C20H30N2O3
Exact Mass 346.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UO24JBMIZg
Name 5-Benzyl-2-t-butyl-3-methyl-4-oxoimidazolidine-1-carboxylic acid, t-butyl ester
Comments Note: The molecular formula of the structure shown is C20H30N2O3 - which differs from the formula reported for the mass spectrum (C20H28D2N2O3)
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Formula C20H28D2N2O3
InChI InChI=1S/C20H30N2O3/c1-19(2,3)17-21(7)16(23)15(13-14-11-9-8-10-12-14)22(17)18(24)25-20(4,5)6/h8-12,15,17H,13H2,1-7H3
InChIKey METIHFSTMAPWHP-UHFFFAOYSA-N
Molecular Weight 346.471 g/mol
SMILES C1(N(C(N(C1=O)C)C(C)(C)C)C(=O)OC(C)(C)C)Cc1ccccc1
SPLASH splash10-0a4m-9220000000-f4df68e843d58fa36497
Synonyms tert-Butyl 5-benzyl-2-tert-butyl-3-methyl-4-oxo-1-imidazolidinecarboxylate 2-tert-Butyl-3-methyl-4-oxo-5-(phenylmethyl)-1-imidazolidinecarboxylic acid tert-butyl ester 5-Benzyl-2-tert-butyl-4-keto-3-methyl-imidazolidine-1-carboxylic acid tert-butyl ester tert-Butyl 2-tert-butyl-3-methyl-4-oxidanylidene-5-(phenylmethyl)imidazolidine-1-carboxylate tert-Butyl 5-benzyl-2-tert-butyl-3-methyl-4-oxo-imidazolidine-1-carboxylate
Wiley ID 1482999