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(+-)-Methyl 2-[2-[(ethoxycarbonyl)methyl]-4-methylphenyl]propionateate
SpectraBase Compound ID JHeksNDkcO8
InChI InChI=1S/C15H20O4/c1-5-19-14(16)9-12-8-10(2)6-7-13(12)11(3)15(17)18-4/h6-8,11H,5,9H2,1-4H3
InChIKey YJMXJOBPYQPUDY-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 D4gkRhaMyPc
Name (+-)-methyl 2-[2-[(ethoxycarbonyl)methyl]-4-methylphenyl]propionateate
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/c1-5-19-14(16)9-12-8-10(2)6-7-13(12)11(3)15(17)18-4/h6-8,11H,5,9H2,1-4H3
InChIKey YJMXJOBPYQPUDY-UHFFFAOYSA-N
Molecular Weight 264.321 g/mol
SMILES C=1(C(C(C(=O)OC)C)=CC=C(C1)C)CC(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.943566