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tert-Butyl N-benzyl-N-methyl-(S)-leucyl-(R)-acetate
SpectraBase Compound ID E0ZiI9mugMw
InChI InChI=1S/C21H33NO4/c1-15(2)13-18(22(7)14-17-11-9-8-10-12-17)20(24)25-16(3)19(23)26-21(4,5)6/h8-12,15-16,18H,13-14H2,1-7H3/t16-,18+/m1/s1
InChIKey ZJXKGTRACVFDJD-AEFFLSMTSA-N
Mol Weight 363.5 g/mol
Molecular Formula C21H33NO4
Exact Mass 363.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFjqVLZ6tVL
Name tert-Butyl N-benzyl-N-methyl-(S)-leucyl-(R)-acetate
Alternate Name(s) tert-Butyl N-benzyl-N-methyl-(S)-leucyl-(R)-2-propanoate (2S)-4-methyl-2-[methyl-(phenylmethyl)amino]pentanoic acid [(2R)-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl] ester [(2R)-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl] (2S)-2-[benzyl(methyl)amino]-4-methylpentanoate [(1R)-2-tert-butoxy-1-methyl-2-oxo-ethyl] (2S)-2-[benzyl(methyl)amino]-4-methyl-pentanoate [(2R)-1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-propan-2-yl] (2S)-4-methyl-2-[methyl-(phenylmethyl)amino]pentanoate
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Formula C21H33NO4
InChI InChI=1S/C21H33NO4/c1-15(2)13-18(22(7)14-17-11-9-8-10-12-17)20(24)25-16(3)19(23)26-21(4,5)6/h8-12,15-16,18H,13-14H2,1-7H3/t16-,18+/m1/s1
InChIKey ZJXKGTRACVFDJD-AEFFLSMTSA-N
Molecular Weight 363.498 g/mol
SMILES C([C@@](N(Cc1ccccc1)C)(CC(C)C)[H])(O[C@@](C(OC(C)(C)C)=O)(C)[H])=O
SPLASH splash10-0006-0900000000-442e334035e68eaa1d37
Source of Spectrum F-51-8464-9
Wiley ID 792726