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(2S)-2-[(5R)-5-(1-ethylpropyl)-4-keto-3-(p-tolyl)imidazolidin-1-yl]-3-methyl-butyric acid methyl ester
SpectraBase Compound ID CFHHJVDM01W
InChI InChI=1S/C21H32N2O3/c1-7-16(8-2)19-20(24)22(17-11-9-15(5)10-12-17)13-23(19)18(14(3)4)21(25)26-6/h9-12,14,16,18-19H,7-8,13H2,1-6H3/t18-,19+/m0/s1
InChIKey JQHYLXKBUYBLIE-RBUKOAKNSA-N
Mol Weight 360.5 g/mol
Molecular Formula C21H32N2O3
Exact Mass 360.241293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 39xqBZwRUbC
Name (2S)-2-[(5R)-5-(1-ethylpropyl)-4-keto-3-(p-tolyl)imidazolidin-1-yl]-3-methyl-butyric acid methyl ester
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Formula C21H32N2O3
InChI InChI=1S/C21H32N2O3/c1-7-16(8-2)19-20(24)22(17-11-9-15(5)10-12-17)13-23(19)18(14(3)4)21(25)26-6/h9-12,14,16,18-19H,7-8,13H2,1-6H3/t18-,19+/m0/s1
InChIKey JQHYLXKBUYBLIE-RBUKOAKNSA-N
Molecular Weight 360.498 g/mol
SMILES C1(N(CN([C@@]1(C(CC)CC)[H])[C@](C(=O)OC)(C(C)C)[H])c1ccc(cc1)C)=O
SPLASH splash10-009i-0970000000-b56825e01aab683f52e3
Source of Spectrum AJ-41-699-5
Synonyms (2S)-3-methyl-2-[(5R)-3-(4-methylphenyl)-4-oxo-5-pentan-3-yl-1-imidazolidinyl]butanoic acid methyl ester Methyl (2S)-2-[(5R)-5-(1-ethylpropyl)-4-oxo-3-(p-tolyl)imidazolidin-1-yl]-3-methyl-butanoate Methyl (2S)-3-methyl-2-[(5R)-3-(4-methylphenyl)-4-oxidanylidene-5-pentan-3-yl-imidazolidin-1-yl]butanoate Methyl (2S)-3-methyl-2-[(5R)-3-(4-methylphenyl)-4-oxo-5-pentan-3-ylimidazolidin-1-yl]butanoate
Wiley ID 1567591