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(2S,5S)-1-tert-Butyloxycarbonyl-2-tert-butyl-3,5-dimethyl-5-(4'-fluorobenzyl)imidazolidin-4-one

View entire compound with spectra: 1 MS (GC)

(2S,5S)-1-tert-Butyloxycarbonyl-2-tert-butyl-3,5-dimethyl-5-(4'-fluorobenzyl)imidazolidin-4-one
SpectraBase Compound ID HLO24Hz9net
InChI InChI=1S/C21H31FN2O3/c1-19(2,3)16-23(8)17(25)21(7,13-14-9-11-15(22)12-10-14)24(16)18(26)27-20(4,5)6/h9-12,16H,13H2,1-8H3/t16-,21-/m0/s1
InChIKey SZANBVCORZWWOX-KKSFZXQISA-N
Mol Weight 378.49 g/mol
Molecular Formula C21H31FN2O3
Exact Mass 378.231871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNu146T1tJX
Name (2S,5S)-1-tert-Butyloxycarbonyl-2-tert-butyl-3,5-dimethyl-5-(4'-fluorobenzyl)imidazolidin-4-one
Alternate Name(s) (2S,3S)-1-tert-Butyloxycarbonyl-2-tert-butyl-3,5-dimethyl-5-(4'-fluorobenzyl)imidazolidin-4-one tert-Butyl (2S,5S)-2-tert-butyl-5-(4-fluorobenzyl)-3,5-dimethyl-4-oxo-1-imidazolidinecarboxylate
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Formula C21H31FN2O3
InChI InChI=1S/C21H31FN2O3/c1-19(2,3)16-23(8)17(25)21(7,13-14-9-11-15(22)12-10-14)24(16)18(26)27-20(4,5)6/h9-12,16H,13H2,1-8H3/t16-,21-/m0/s1
InChIKey SZANBVCORZWWOX-KKSFZXQISA-N
Molecular Weight 378.488 g/mol
SMILES [C@@]1(N([C@](C(N1C)=O)(Cc1ccc(cc1)F)C)C(OC(C)(C)C)=O)(C(C)(C)C)[H]
SPLASH splash10-01b9-1091000000-58820f58a42d3d76f409
Source of Spectrum F-53-5791-3
Wiley ID 801823