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

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

5-oxo-1-(3,4,5-Trimethoxybenzyl)-2-pyrrolidinecarboxylic acid
SpectraBase Compound ID DriqNQaHkEt
InChI InChI=1S/C15H19NO6/c1-20-11-6-9(7-12(21-2)14(11)22-3)8-16-10(15(18)19)4-5-13(16)17/h6-7,10H,4-5,8H2,1-3H3,(H,18,19)
InChIKey LXXOVXRFFJHSSI-UHFFFAOYSA-N
Mol Weight 309.32 g/mol
Molecular Formula C15H19NO6
Exact Mass 309.121237 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID B4sTgFwxBt2
Name 5-oxo-1-(3,4,5-Trimethoxybenzyl)-2-pyrrolidinecarboxylic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.121237330 u
Formula C15H19NO6
InChI InChI=1S/C15H19NO6/c1-20-11-6-9(7-12(21-2)14(11)22-3)8-16-10(15(18)19)4-5-13(16)17/h6-7,10H,4-5,8H2,1-3H3,(H,18,19)
InChIKey LXXOVXRFFJHSSI-UHFFFAOYSA-N
Molecular Weight 309.318 g/mol
SMILES OC(C1CCC(N1CC1=CC(=C(C(=C1)OC)OC)OC)=O)=O
Spectrum/Structure Validation Score (Raman) 0.962285