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N-Carbobenzyloxy-4-hydroxy-L-prolylglycine ethyl ester
SpectraBase Compound ID APBDlcnYXQL
InChI InChI=1S/C17H22N2O6/c1-2-24-15(21)9-18-16(22)14-8-13(20)10-19(14)17(23)25-11-12-6-4-3-5-7-12/h3-7,13-14,20H,2,8-11H2,1H3,(H,18,22)/t13?,14-/m0/s1
InChIKey QZVZXJROYIWKOQ-KZUDCZAMSA-N
Mol Weight 350.37 g/mol
Molecular Formula C17H22N2O6
Exact Mass 350.147786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EALtJ1rs1H8
Name N-Carbobenzyloxy-4-hydroxy-L-prolylglycine ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 350.147786430 u
Formula C17H22N2O6
InChI InChI=1S/C17H22N2O6/c1-2-24-15(21)9-18-16(22)14-8-13(20)10-19(14)17(23)25-11-12-6-4-3-5-7-12/h3-7,13-14,20H,2,8-11H2,1H3,(H,18,22)/t13?,14-/m0/s1
InChIKey QZVZXJROYIWKOQ-KZUDCZAMSA-N
Molecular Weight 350.371 g/mol
SMILES C1N([C@@](CC1O)(C(NCC(=O)OCC)=O)[H])C(=O)OCC1=CC=CC=C1