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2-[(1S)-1-(benzyloxycarbonylamino)-2-methyl-propyl]-5-methyl-oxazole-4-carboxylic acid

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2-[(1S)-1-(benzyloxycarbonylamino)-2-methyl-propyl]-5-methyl-oxazole-4-carboxylic acid
SpectraBase Compound ID 9FGwdrA5ktk
InChI InChI=1S/C17H20N2O5/c1-10(2)13(15-18-14(16(20)21)11(3)24-15)19-17(22)23-9-12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3,(H,19,22)(H,20,21)/t13-/m0/s1
InChIKey NEXGTNKMMOBTFW-ZDUSSCGKSA-N
Mol Weight 332.36 g/mol
Molecular Formula C17H20N2O5
Exact Mass 332.137222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Rz7vDvkDPq
Name 2-[(1S)-1-(Benzyloxycarbonylamino)-2-methyl-propyl]-5-methyl-oxazole-4-carboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.137221747 u
Formula C17H20N2O5
InChI InChI=1S/C17H20N2O5/c1-10(2)13(15-18-14(16(20)21)11(3)24-15)19-17(22)23-9-12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3,(H,19,22)(H,20,21)/t13-/m0/s1
InChIKey NEXGTNKMMOBTFW-ZDUSSCGKSA-N
Molecular Weight 332.356 g/mol
SMILES C=1(N=C([C@@](NC(=O)OCC=2C=CC=CC2)(C(C)C)[H])OC1C)C(=O)O