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Malonic acid, benzyl-, diethyl ester

View entire compound with spectra: 4 NMR, 5 FTIR, 1 Raman, 7 MS (GC), and 2 Near IR

Malonic acid, benzyl-, diethyl ester
SpectraBase Compound ID JnjIvQO7Uqg
InChI InChI=1S/C14H18O4/c1-3-17-13(15)12(14(16)18-4-2)10-11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3
InChIKey ICZLTZWATFXDLP-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AnI3R6Gb0Jv
Name Diethyl benzylmalonate
Source of Sample Aldrich
Catalog Number 135542
CAS Registry Number 607-81-8
Classification Aromatic esters and lactones
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-3-17-13(15)12(14(16)18-4-2)10-11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3
InChIKey ICZLTZWATFXDLP-UHFFFAOYSA-N
Purity 98%
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Neat
Wiley ID SIAL_FTIR_1_1055