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Glutaric acid, ethyl 1-phenylethyl ester
SpectraBase Compound ID 2D3QN3g9WmN
InChI InChI=1S/C15H20O4/c1-3-18-14(16)10-7-11-15(17)19-12(2)13-8-5-4-6-9-13/h4-6,8-9,12H,3,7,10-11H2,1-2H3
InChIKey CTQWYVMHBOPPCN-UHFFFAOYSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1lXNs4qLHG8
Name Glutaric acid, ethyl 1-phenylethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.136159120 u
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-3-18-14(16)10-7-11-15(17)19-12(2)13-8-5-4-6-9-13/h4-6,8-9,12H,3,7,10-11H2,1-2H3
InChIKey CTQWYVMHBOPPCN-UHFFFAOYSA-N
Molecular Weight 264.321 g/mol
SMILES C(OC(C)C1=CC=CC=C1)(=O)CCCC(OCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955151