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(2S)-Methyl 2-(N-tert-butoxycarbonylamino)-4-oxo-4-phenylbutanoate
SpectraBase Compound ID I1L3vYbqsHD
InChI InChI=1S/C16H21NO5/c1-16(2,3)22-15(20)17-12(14(19)21-4)10-13(18)11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3,(H,17,20)/t12-/m0/s1
InChIKey XJTLAFARPRUEMI-LBPRGKRZSA-N
Mol Weight 307.35 g/mol
Molecular Formula C16H21NO5
Exact Mass 307.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1FvFmuO20c
Name (2S)-Methyl 2-(N-tert-butoxycarbonylamino)-4-oxo-4-phenylbutanoate
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Formula C16H21NO5
InChI InChI=1S/C16H21NO5/c1-16(2,3)22-15(20)17-12(14(19)21-4)10-13(18)11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3,(H,17,20)/t12-/m0/s1
InChIKey XJTLAFARPRUEMI-LBPRGKRZSA-N
Molecular Weight 307.346 g/mol
SMILES N([C@@](CC(=O)c1ccccc1)(C(=O)OC)[H])C(OC(C)(C)C)=O
SPLASH splash10-0007-0950000000-96a5550ab6ddf2e8ec7e
Source of Spectrum KC-0-867-8
Synonyms Methyl (2S)-2-[(tert-butoxycarbonyl)amino]-4-oxo-4-phenylbutanoate (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-4-phenylbutanoic acid methyl ester Methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-4-phenylbutanoate Methyl (2S)-2-(tert-butoxycarbonylamino)-4-oxo-4-phenyl-butanoate Methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-phenyl-butanoate
Wiley ID 787748