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1-(o-Biphenyl)-5-oxo-3-pyrrolidinecarboxylic acid
SpectraBase Compound ID 41O3vRfGKVc
InChI InChI=1S/C17H15NO3/c19-16-10-13(17(20)21)11-18(16)15-9-5-4-8-14(15)12-6-2-1-3-7-12/h1-9,13H,10-11H2,(H,20,21)
InChIKey ISSGTEFJBZUYEX-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C17H15NO3
Exact Mass 281.105193 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 5332E33j0ZJ
Name 1-(o-Biphenyl)-5-oxo-3-pyrrolidinecarboxylic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.105193344 u
Formula C17H15NO3
InChI InChI=1S/C17H15NO3/c19-16-10-13(17(20)21)11-18(16)15-9-5-4-8-14(15)12-6-2-1-3-7-12/h1-9,13H,10-11H2,(H,20,21)
InChIKey ISSGTEFJBZUYEX-UHFFFAOYSA-N
Molecular Weight 281.311 g/mol
SMILES OC(C1CC(N(C1)C1=CC=CC=C1C1=CC=CC=C1)=O)=O
Spectrum/Structure Validation Score (Raman) 0.917049