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Succinic acid, 1,1,1-trifluoroprop-2-yl 2-methoxy-5-methylphenyl ester
SpectraBase Compound ID 411BfbZgyID
InChI InChI=1S/C15H17F3O5/c1-9-4-5-11(21-3)12(8-9)23-14(20)7-6-13(19)22-10(2)15(16,17)18/h4-5,8,10H,6-7H2,1-3H3
InChIKey GFMUKDUKGXXXHL-UHFFFAOYSA-N
Mol Weight 334.29 g/mol
Molecular Formula C15H17F3O5
Exact Mass 334.102808 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AJrG0Mv3gxY
Name Succinic acid, 1,1,1-trifluoroprop-2-yl 2-methoxy-5-methylphenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.102808131 u
Formula C15H17F3O5
InChI InChI=1S/C15H17F3O5/c1-9-4-5-11(21-3)12(8-9)23-14(20)7-6-13(19)22-10(2)15(16,17)18/h4-5,8,10H,6-7H2,1-3H3
InChIKey GFMUKDUKGXXXHL-UHFFFAOYSA-N
Molecular Weight 334.291 g/mol
SMILES C(CC(OC(C)C(F)(F)F)=O)C(OC1=C(C=CC(=C1)C)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956295