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2-Fluorobenzyl alcohol, heptafluorobutyrate

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

2-Fluorobenzyl alcohol, heptafluorobutyrate
SpectraBase Compound ID HntmL9EFgt9
InChI InChI=1S/C11H6F8O2/c12-7-4-2-1-3-6(7)5-21-8(20)9(13,14)10(15,16)11(17,18)19/h1-4H,5H2
InChIKey DCSLBUPWESLQAT-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

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SpectraBase Spectrum ID 7XcZSbQTLBF
Name 2-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/c12-7-4-2-1-3-6(7)5-21-8(20)9(13,14)10(15,16)11(17,18)19/h1-4H,5H2
InChIKey DCSLBUPWESLQAT-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) 0.913991