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Ethyl 2-benzylacetoacetate

View entire compound with spectra: 7 NMR, 9 FTIR, 2 Raman, and 2 MS (GC)

Ethyl 2-benzylacetoacetate
SpectraBase Compound ID 6rTZeYVlNTG
InChI InChI=1S/C13H16O3/c1-3-16-13(15)12(10(2)14)9-11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3
InChIKey XDWQYMXQMNUWID-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 2XmabrtB2Bx
Name Ethyl 2-acetyl-3-phenylpropionate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number W241601
Lot Number 06307TE
CAS Registry Number 620-79-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-3-16-13(15)12(10(2)14)9-11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3
InChIKey XDWQYMXQMNUWID-UHFFFAOYSA-N
Molecular Weight 220.268 g/mol
Purity >=97%
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Ethyl 2-benzylacetoacetate
Wiley ID SIAL_FF-FTIR_000567