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Oxalic acid, pentyl 2-phenylethyl ester

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Oxalic acid, pentyl 2-phenylethyl ester
SpectraBase Compound ID L3mI3XfCl1X
InChI InChI=1S/C15H20O4/c1-2-3-7-11-18-14(16)15(17)19-12-10-13-8-5-4-6-9-13/h4-6,8-9H,2-3,7,10-12H2,1H3
InChIKey QZYKWOYBXUAAIE-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 9Wof8ROmUMV
Name Oxalic acid, pentyl 2-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/c1-2-3-7-11-18-14(16)15(17)19-12-10-13-8-5-4-6-9-13/h4-6,8-9H,2-3,7,10-12H2,1H3
InChIKey QZYKWOYBXUAAIE-UHFFFAOYSA-N
Molecular Weight 264.321 g/mol
SMILES CCCCCOC(C(OCCC1=CC=CC=C1)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826114