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phenylmalonic acid, cyclic isopropylidene ester

View entire compound with spectra: 5 NMR, 3 FTIR, and 1 Raman

phenylmalonic acid, cyclic isopropylidene ester
SpectraBase Compound ID L5jwZIREMBo
InChI InChI=1S/C12H12O4/c1-12(2)15-10(13)9(11(14)16-12)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKey NTUAHNQWHPQAMB-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID JXbnfduUuha
Name 2,2-Dimethyl-5-phenyl-1,3-dioxane-4,6-dione
Catalog Number 225223
CAS Registry Number 15231-78-4
Classification Aromatic esters and lactones
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-12(2)15-10(13)9(11(14)16-12)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKey NTUAHNQWHPQAMB-UHFFFAOYSA-N
Purity 98%
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Mull
Wiley ID SIAL_FTIR_1_3743