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2-(3,4-Dimethoxyphenyl)-1-methyl-5-oxo-3-pyrrolidinecarboxylic acid

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

2-(3,4-Dimethoxyphenyl)-1-methyl-5-oxo-3-pyrrolidinecarboxylic acid
SpectraBase Compound ID Gjy9uqCTOYu
InChI InChI=1S/C14H17NO5/c1-15-12(16)7-9(14(17)18)13(15)8-4-5-10(19-2)11(6-8)20-3/h4-6,9,13H,7H2,1-3H3,(H,17,18)
InChIKey IGCUAQHQLRVAAG-UHFFFAOYSA-N
Mol Weight 279.29 g/mol
Molecular Formula C14H17NO5
Exact Mass 279.110673 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID ElnbcsOCxBJ
Name 2-(3,4-Dimethoxyphenyl)-1-methyl-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 279.110672646 u
Formula C14H17NO5
InChI InChI=1S/C14H17NO5/c1-15-12(16)7-9(14(17)18)13(15)8-4-5-10(19-2)11(6-8)20-3/h4-6,9,13H,7H2,1-3H3,(H,17,18)
InChIKey IGCUAQHQLRVAAG-UHFFFAOYSA-N
SMILES OC(C1CC(N(C1C1=CC=C(C(=C1)OC)OC)C)=O)=O
Spectrum/Structure Validation Score (Raman) 0.967063