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2-Hydroxy-5-methoxybenzoic acid, 1,1,1-trifluoro-2-propyl ester

View entire compound with spectra: 1 FTIR

2-Hydroxy-5-methoxybenzoic acid, 1,1,1-trifluoro-2-propyl ester
SpectraBase Compound ID D8c723DYVAV
InChI InChI=1S/C11H11F3O4/c1-6(11(12,13)14)18-10(16)8-5-7(17-2)3-4-9(8)15/h3-6,15H,1-2H3
InChIKey QQXBLQNNQKOXCX-UHFFFAOYSA-N
Mol Weight 264.2 g/mol
Molecular Formula C11H11F3O4
Exact Mass 264.060943 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8KPBBf6gZb0
Name 2-Hydroxy-5-methoxybenzoic acid, 1,1,1-trifluoro-2-propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.060943319 u
Formula C11H11F3O4
InChI InChI=1S/C11H11F3O4/c1-6(11(12,13)14)18-10(16)8-5-7(17-2)3-4-9(8)15/h3-6,15H,1-2H3
InChIKey QQXBLQNNQKOXCX-UHFFFAOYSA-N
Molecular Weight 264.200 g/mol
SMILES C1(=CC=C(C(=C1)C(=O)OC(C(F)(F)F)C)O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826585