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L-Phenylalanine, N-benzyloxycarbonyl-, benzyl ester
SpectraBase Compound ID E4ehhFbOPur
InChI InChI=1S/C24H23NO4/c26-23(28-17-20-12-6-2-7-13-20)22(16-19-10-4-1-5-11-19)25-24(27)29-18-21-14-8-3-9-15-21/h1-15,22H,16-18H2,(H,25,27)
InChIKey ILHGLRRAUKTLLN-UHFFFAOYSA-N
Mol Weight 389.45 g/mol
Molecular Formula C24H23NO4
Exact Mass 389.162708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiCEC5uXCQ5
Name L-Phenylalanine, N-benzyloxycarbonyl-, benzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 389.162708221 u
Formula C24H23NO4
InChI InChI=1S/C24H23NO4/c26-23(28-17-20-12-6-2-7-13-20)22(16-19-10-4-1-5-11-19)25-24(27)29-18-21-14-8-3-9-15-21/h1-15,22H,16-18H2,(H,25,27)
InChIKey ILHGLRRAUKTLLN-UHFFFAOYSA-N
Molecular Weight 389.451 g/mol
SMILES C(OC(NC(C(OCC1=CC=CC=C1)=O)CC1=CC=CC=C1)=O)C1=CC=CC=C1