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2-[(2S)-1-benzyloxycarbonylpyrrolidin-2-yl]-5-methyl-oxazole-4-carboxylic acid

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

2-[(2S)-1-benzyloxycarbonylpyrrolidin-2-yl]-5-methyl-oxazole-4-carboxylic acid
SpectraBase Compound ID FTXXLRZrfRh
InChI InChI=1S/C17H18N2O5/c1-11-14(16(20)21)18-15(24-11)13-8-5-9-19(13)17(22)23-10-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-10H2,1H3,(H,20,21)/t13-/m0/s1
InChIKey KTEHJUOQDRVAAC-ZDUSSCGKSA-N
Mol Weight 330.34 g/mol
Molecular Formula C17H18N2O5
Exact Mass 330.121572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BUSYJINUt5n
Name 2-[(2S)-1-Benzyloxycarbonylpyrrolidin-2-yl]-5-methyl-oxazole-4-carboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.121571683 u
Formula C17H18N2O5
InChI InChI=1S/C17H18N2O5/c1-11-14(16(20)21)18-15(24-11)13-8-5-9-19(13)17(22)23-10-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-10H2,1H3,(H,20,21)/t13-/m0/s1
InChIKey KTEHJUOQDRVAAC-ZDUSSCGKSA-N
Molecular Weight 330.340 g/mol
SMILES C=1(N=C([C@]2(N(C(OCC=3C=CC=CC3)=O)CCC2)[H])OC1C)C(=O)O