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(2S)-[N-(t-Butoxycarbonyl)amino]-3-(5'-bromopyrid-2'-yl)propionic acid - Methyl ester
SpectraBase Compound ID 9RBMLbiChhK
InChI InChI=1S/C14H19BrN2O4/c1-14(2,3)21-13(19)17-11(12(18)20-4)7-10-6-5-9(15)8-16-10/h5-6,8,11H,7H2,1-4H3,(H,17,19)/t11-/m0/s1
InChIKey NYOJIOILNSLTLC-NSHDSACASA-N
Mol Weight 359.22 g/mol
Molecular Formula C14H19BrN2O4
Exact Mass 358.05282 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HlbFU01GiYc
Name (2S)-[N-(t-Butoxycarbonyl)amino]-3-(5'-bromopyrid-2'-yl)propionic acid - Methyl ester
Alternate Name(s) (S)-methyl 3-(5-bromopyridin-2-yl)-2-((tert-butoxycarbonyl)amino)propanoate (2S)-3-(5-bromo-2-pyridinyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester Methyl (2S)-3-(5-bromopyridin-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Methyl (2S)-3-(5-bromo-2-pyridyl)-2-(tert-butoxycarbonylamino)propanoate Methyl (2S)-3-(5-bromanylpyridin-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
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Formula C14H19BrN2O4
InChI InChI=1S/C14H19BrN2O4/c1-14(2,3)21-13(19)17-11(12(18)20-4)7-10-6-5-9(15)8-16-10/h5-6,8,11H,7H2,1-4H3,(H,17,19)/t11-/m0/s1
InChIKey NYOJIOILNSLTLC-NSHDSACASA-N
Molecular Weight 359.220 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(=O)OC)(Cc1ncc(cc1)Br)[H]
SPLASH splash10-0pb9-5139000000-7386ec02b00bdf3994b8
Source of Spectrum F5-1-4258-6b
Wiley ID 1731604