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Succinic acid, 4-methylbenzyl propyl ester

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Succinic acid, 4-methylbenzyl propyl ester
SpectraBase Compound ID FGmwvFTwi3I
InChI InChI=1S/C15H20O4/c1-3-10-18-14(16)8-9-15(17)19-11-13-6-4-12(2)5-7-13/h4-7H,3,8-11H2,1-2H3
InChIKey RVAUKQCMELZPJE-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 3BI3vzfnpct
Name Succinic acid, 4-methylbenzyl propyl 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/c1-3-10-18-14(16)8-9-15(17)19-11-13-6-4-12(2)5-7-13/h4-7H,3,8-11H2,1-2H3
InChIKey RVAUKQCMELZPJE-UHFFFAOYSA-N
Molecular Weight 264.321 g/mol
SMILES C(CCC(OCC=1C=CC(=CC1)C)=O)(OCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.967259