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Trifluoroacetic acid,N-tridecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Trifluoroacetic acid,N-tridecyl ester
SpectraBase Compound ID CagVR2Hdvur
InChI InChI=1S/C15H27F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-14(19)15(16,17)18/h2-13H2,1H3
InChIKey DKWJQENYIDPCEX-UHFFFAOYSA-N
Mol Weight 296.37 g/mol
Molecular Formula C15H27F3O2
Exact Mass 296.196315 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LY06SjFyjuI
Name Trifluoroacetic acid,N-tridecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.196314596 u
Formula C15H27F3O2
InChI InChI=1S/C15H27F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-14(19)15(16,17)18/h2-13H2,1H3
InChIKey DKWJQENYIDPCEX-UHFFFAOYSA-N
Molecular Weight 296.374 g/mol
SMILES C(F)(C(=O)OCCCCCCCCCCCCC)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.972308