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BOC-PHE-ALA-O-ME
SpectraBase Compound ID KqZU6p7bAL5
InChI InChI=1S/C18H26N2O5/c1-12(16(22)24-5)19-15(21)14(11-13-9-7-6-8-10-13)20-17(23)25-18(2,3)4/h6-10,12,14H,11H2,1-5H3,(H,19,21)(H,20,23)/t12-,14-/m0/s1
InChIKey KQKWBQWQIAVCLZ-JSGCOSHPSA-N
Mol Weight 350.42 g/mol
Molecular Formula C18H26N2O5
Exact Mass 350.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwSN4A0M7DU
Name N-Boc-L-phenylalanyl-L-alanine methyl ester
Alternate Name(s) (S)-methyl 2-((S)-2-((tert-butoxycarbonyl)amino)-3-phenylpropanamido)propanoate (2S)-2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]propanoic acid methyl ester Methyl (2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]propanoate Methyl (2S)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]propanoate Methyl (2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]propanoate
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Formula C18H26N2O5
InChI InChI=1S/C18H26N2O5/c1-12(16(22)24-5)19-15(21)14(11-13-9-7-6-8-10-13)20-17(23)25-18(2,3)4/h6-10,12,14H,11H2,1-5H3,(H,19,21)(H,20,23)/t12-,14-/m0/s1
InChIKey KQKWBQWQIAVCLZ-JSGCOSHPSA-N
Literature Reference DOI 10.1039/c3ra46599c
Molecular Weight 350.415 g/mol
SMILES N(C(=O)OC(C)(C)C)[C@](C(N[C@@](C(OC)=O)([H])C)=O)(Cc1ccccc1)[H]
SPLASH splash10-0ab9-6910000000-3c8e9e3fac6b652e8a55
Source of Spectrum RSA-4-2684-8
Wiley ID 1747899