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3-Cyclopentylpropionic acid, 2-dimethylaminoethyl ester

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3-Cyclopentylpropionic acid, 2-dimethylaminoethyl ester
SpectraBase Compound ID 5LDb9ANe9WG
InChI InChI=1S/C12H23NO2/c1-13(2)9-10-15-12(14)8-7-11-5-3-4-6-11/h11H,3-10H2,1-2H3
InChIKey MXAXYEGDUFNYRX-UHFFFAOYSA-N
Mol Weight 213.32 g/mol
Molecular Formula C12H23NO2
Exact Mass 213.172879 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID RgUCV5tAe1
Name 3-Cyclopentylpropionic acid, 2-dimethylaminoethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 213.172878983 u
Formula C12H23NO2
InChI InChI=1S/C12H23NO2/c1-13(2)9-10-15-12(14)8-7-11-5-3-4-6-11/h11H,3-10H2,1-2H3
InChIKey MXAXYEGDUFNYRX-UHFFFAOYSA-N
Molecular Weight 213.321 g/mol
SMILES C(CCC1CCCC1)(OCCN(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.948922