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Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-methylbut-3-en-1-yl ester

View entire compound with spectra: 1 FTIR

Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-methylbut-3-en-1-yl ester
SpectraBase Compound ID LEfQyEIoB8l
InChI InChI=1S/C13H19F3O4/c1-9(2)7-8-19-11(17)5-4-6-12(18)20-10(3)13(14,15)16/h10H,1,4-8H2,2-3H3
InChIKey SQXDMKAVRWMXGU-UHFFFAOYSA-N
Mol Weight 296.29 g/mol
Molecular Formula C13H19F3O4
Exact Mass 296.123544 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3GJk3IQOxZh
Name Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-methylbut-3-en-1-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.123543577 u
Formula C13H19F3O4
InChI InChI=1S/C13H19F3O4/c1-9(2)7-8-19-11(17)5-4-6-12(18)20-10(3)13(14,15)16/h10H,1,4-8H2,2-3H3
InChIKey SQXDMKAVRWMXGU-UHFFFAOYSA-N
Molecular Weight 296.286 g/mol
SMILES C(CCC(OC(C)C(F)(F)F)=O)C(OCCC(C)=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963887