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[L-(trans)]/[L-cis)]-4-[(t-Butoxycarbonyl)amino]-2-methyl-5-phenyl-2-pentenoic acid
SpectraBase Compound ID I5Vlhgdn6Ks
InChI InChI=1S/C17H23NO4/c1-12(15(19)20)10-14(11-13-8-6-5-7-9-13)18-16(21)22-17(2,3)4/h5-10,14H,11H2,1-4H3,(H,18,21)(H,19,20)/b12-10+/t14-/m1/s1
InChIKey DWCRWWOCTYJYRV-IEZBTEQYSA-N
Mol Weight 305.37 g/mol
Molecular Formula C17H23NO4
Exact Mass 305.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcdR7k5tko3
Name [L-(trans)]/[L-cis)]-4-[(t-Butoxycarbonyl)amino]-2-methyl-5-phenyl-2-pentenoic acid
Alternate Name(s) (E,4S)-2-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenyl-2-pentenoic acid (E,4S)-2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpent-2-enoic acid (E,4S)-2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pent-2-enoic acid
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Formula C17H23NO4
InChI InChI=1S/C17H23NO4/c1-12(15(19)20)10-14(11-13-8-6-5-7-9-13)18-16(21)22-17(2,3)4/h5-10,14H,11H2,1-4H3,(H,18,21)(H,19,20)/b12-10+/t14-/m1/s1
InChIKey DWCRWWOCTYJYRV-IEZBTEQYSA-N
Molecular Weight 305.374 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](\C=C\(C(=O)O)C)(Cc1ccccc1)[H]
SPLASH splash10-01ox-9810000000-72091200c6ab799c1251
Source of Spectrum KC-57-4912-4
Wiley ID 1624428