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3-Ethoxy-1-(4-methoxyphenyl)pyrrolidine-2,2-dicarboxylicacid,diethyl ester
SpectraBase Compound ID 7YPTzlf8F8J
InChI InChI=1S/C19H27NO6/c1-5-24-16-12-13-20(14-8-10-15(23-4)11-9-14)19(16,17(21)25-6-2)18(22)26-7-3/h8-11,16H,5-7,12-13H2,1-4H3
InChIKey DGSCSHAXCCKFHW-UHFFFAOYSA-N
Mol Weight 365.43 g/mol
Molecular Formula C19H27NO6
Exact Mass 365.183838 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8fLsHWY80Y
Name 3-Ethoxy-1-(4-methoxyphenyl)pyrrolidine-2,2-dicarboxylicacid,diethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 365.183837587 u
Formula C19H27NO6
InChI InChI=1S/C19H27NO6/c1-5-24-16-12-13-20(14-8-10-15(23-4)11-9-14)19(16,17(21)25-6-2)18(22)26-7-3/h8-11,16H,5-7,12-13H2,1-4H3
InChIKey DGSCSHAXCCKFHW-UHFFFAOYSA-N
Molecular Weight 365.426 g/mol
SMILES C1N(C(C(C1)OCC)(C(OCC)=O)C(OCC)=O)C1=CC=C(C=C1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962427