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Octanoic acid, 2-dimethylaminoethyl ester
SpectraBase Compound ID GAmHbt0ed7
InChI InChI=1S/C12H25NO2/c1-4-5-6-7-8-9-12(14)15-11-10-13(2)3/h4-11H2,1-3H3
InChIKey RBLJYVBVMVTWKL-UHFFFAOYSA-N
Mol Weight 215.34 g/mol
Molecular Formula C12H25NO2
Exact Mass 215.188529 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JwWd3C2f1K7
Name Octanoic acid, 2-dimethylaminoethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 215.188529047 u
Formula C12H25NO2
InChI InChI=1S/C12H25NO2/c1-4-5-6-7-8-9-12(14)15-11-10-13(2)3/h4-11H2,1-3H3
InChIKey RBLJYVBVMVTWKL-UHFFFAOYSA-N
Molecular Weight 215.337 g/mol
SMILES C(CCCCCCC)(=O)OCCN(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.983874