For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-Hydroxy-5-methoxybenzaldehyde, pentafluoropropionate

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

2-Hydroxy-5-methoxybenzaldehyde, pentafluoropropionate
SpectraBase Compound ID 5zF83VKrgYW
InChI InChI=1S/C11H7F5O4/c1-19-7-2-3-8(6(4-7)5-17)20-9(18)10(12,13)11(14,15)16/h2-5H,1H3
InChIKey BAFGXVZXNHTPGB-UHFFFAOYSA-N
Mol Weight 298.17 g/mol
Molecular Formula C11H7F5O4
Exact Mass 298.02645 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BHwChxM5t1E
Name 2-Hydroxy-5-methoxybenzaldehyde, pentafluoropropionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 298.026449516 u
Formula C11H7F5O4
InChI InChI=1S/C11H7F5O4/c1-19-7-2-3-8(6(4-7)5-17)20-9(18)10(12,13)11(14,15)16/h2-5H,1H3
InChIKey BAFGXVZXNHTPGB-UHFFFAOYSA-N
Molecular Weight 298.165 g/mol
SMILES C1(=C(C=CC(=C1)OC)OC(C(C(F)(F)F)(F)F)=O)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.905897