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N-[(Tert-butoxycarbonyl)methyl]-N-[(S)-1-(1-naphthyl)ethyl]-2-(benzyloxy)acetamide
SpectraBase Compound ID JbprlL2rTVw
InChI InChI=1S/C27H31NO4/c1-20(23-16-10-14-22-13-8-9-15-24(22)23)28(17-26(30)32-27(2,3)4)25(29)19-31-18-21-11-6-5-7-12-21/h5-16,20H,17-19H2,1-4H3/t20-/m0/s1
InChIKey LGUDFMHKXQNJCR-FQEVSTJZSA-N
Mol Weight 433.55 g/mol
Molecular Formula C27H31NO4
Exact Mass 433.225308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45tabmoBX0B
Name N-[(Tert-butoxycarbonyl)methyl]-N-[(S)-1-(1-naphthyl)ethyl]-2-(benzyloxy)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 433.225308478 u
Formula C27H31NO4
InChI InChI=1S/C27H31NO4/c1-20(23-16-10-14-22-13-8-9-15-24(22)23)28(17-26(30)32-27(2,3)4)25(29)19-31-18-21-11-6-5-7-12-21/h5-16,20H,17-19H2,1-4H3/t20-/m0/s1
InChIKey LGUDFMHKXQNJCR-FQEVSTJZSA-N
Molecular Weight 433.548 g/mol
SMILES [C@](N(C(=O)COCC=1C=CC=CC1)CC(OC(C)(C)C)=O)(C1=C2C(C=CC=C2)=CC=C1)(C)[H]