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2S-[(t-Butoxycarbonyl)amino]-3-(3'-hydroxyphenyl)-propionic acid - Methyl ester
SpectraBase Compound ID IoIDPiig5nu
InChI InChI=1S/C15H21NO5/c1-15(2,3)21-14(19)16-12(13(18)20-4)9-10-6-5-7-11(17)8-10/h5-8,12,17H,9H2,1-4H3,(H,16,19)/t12-/m0/s1
InChIKey KNOXVYSIGXFFRD-LBPRGKRZSA-N
Mol Weight 295.33 g/mol
Molecular Formula C15H21NO5
Exact Mass 295.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eh7NGfbrawb
Name 2S-[(t-Butoxycarbonyl)amino]-3-(3'-hydroxyphenyl)-propionic acid - Methyl ester
Alternate Name(s) (S)-methyl 2-((tert-butoxycarbonyl)amino)-3-(3-hydroxyphenyl)propanoate (2S)-3-(3-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester Methyl (2S)-2-(tert-butoxycarbonylamino)-3-(3-hydroxyphenyl)propanoate Methyl (2S)-3-(3-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
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Formula C15H21NO5
InChI InChI=1S/C15H21NO5/c1-15(2,3)21-14(19)16-12(13(18)20-4)9-10-6-5-7-11(17)8-10/h5-8,12,17H,9H2,1-4H3,(H,16,19)/t12-/m0/s1
InChIKey KNOXVYSIGXFFRD-LBPRGKRZSA-N
Molecular Weight 295.335 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](Cc1cc(ccc1)O)(C(=O)OC)[H]
SPLASH splash10-004i-0910000000-aa8e041984d3462b4fdf
Source of Spectrum F5-2-113-9b
Wiley ID 1731643