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

*Links on SpectraBase are not permalinks.

4-Fluorobenzyl alcohol, heptafluorobutyrate

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

4-Fluorobenzyl alcohol, heptafluorobutyrate
SpectraBase Compound ID 1tjFkLBoRmn
InChI InChI=1S/C11H6F8O2/c12-7-3-1-6(2-4-7)5-21-8(20)9(13,14)10(15,16)11(17,18)19/h1-4H,5H2
InChIKey QXQYDEPVNJYVDH-UHFFFAOYSA-N
Mol Weight 322.15 g/mol
Molecular Formula C11H6F8O2
Exact Mass 322.024005 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 4t4o2MHf7o6
Name 4-Fluorobenzyl alcohol, heptafluorobutyrate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.024004735 u
Formula C11H6F8O2
InChI InChI=1S/C11H6F8O2/c12-7-3-1-6(2-4-7)5-21-8(20)9(13,14)10(15,16)11(17,18)19/h1-4H,5H2
InChIKey QXQYDEPVNJYVDH-UHFFFAOYSA-N
Molecular Weight 322.154 g/mol
SMILES C1=CC(=CC=C1COC(=O)C(C(C(F)(F)F)(F)F)(F)F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954913