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1-Propanol, (2s)-[(tert.butyloxycarbonyl)-(s)-(phenylalanyl)amino]-3-phenyl-

View entire compound with spectra: 1 NMR, and 4 MS (GC)

1-Propanol, (2s)-[(tert.butyloxycarbonyl)-(s)-(phenylalanyl)amino]-3-phenyl-
SpectraBase Compound ID 8GlPbKFuSRd
InChI InChI=1S/C23H30N2O4/c1-23(2,3)29-22(28)25-20(15-18-12-8-5-9-13-18)21(27)24-19(16-26)14-17-10-6-4-7-11-17/h4-13,19-20,26H,14-16H2,1-3H3,(H,24,27)(H,25,28)
InChIKey NJHMAAPAVVLGRK-UHFFFAOYSA-N
Mol Weight 398.5 g/mol
Molecular Formula C23H30N2O4
Exact Mass 398.220557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7sdf5dC2Pbj
Name 1-Propanol, (2S)-[(tert.butyloxycarbonyl)-(S)-(phenylalanyl)amino]-3-phenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.220557450 u
Formula C23H30N2O4
InChI InChI=1S/C23H30N2O4/c1-23(2,3)29-22(28)25-20(15-18-12-8-5-9-13-18)21(27)24-19(16-26)14-17-10-6-4-7-11-17/h4-13,19-20,26H,14-16H2,1-3H3,(H,24,27)(H,25,28)
InChIKey NJHMAAPAVVLGRK-UHFFFAOYSA-N
Molecular Weight 398.503 g/mol
SMILES C1=CC=CC(=C1)C[C@@](CO)(NC(=O)[C@](CC1=CC=CC=C1)(NC(OC(C)(C)C)=O)[H])[H]