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

*Links on SpectraBase are not permalinks.

1,2-Benzenediol, o-(2,2,3,3,4,4,4-heptafluorobutyryl)-

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

1,2-Benzenediol, o-(2,2,3,3,4,4,4-heptafluorobutyryl)-
SpectraBase Compound ID JqSKJW68omj
InChI InChI=1S/C10H5F7O3/c11-8(12,9(13,14)10(15,16)17)7(19)20-6-4-2-1-3-5(6)18/h1-4,18H
InChIKey SKPBYHQAMFQHRU-UHFFFAOYSA-N
Mol Weight 306.14 g/mol
Molecular Formula C10H5F7O3
Exact Mass 306.012691 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 LDd4Po6w35F
Name 1,2-Benzenediol, o-(2,2,3,3,4,4,4-heptafluorobutyryl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.012691159 u
Formula C10H5F7O3
InChI InChI=1S/C10H5F7O3/c11-8(12,9(13,14)10(15,16)17)7(19)20-6-4-2-1-3-5(6)18/h1-4,18H
InChIKey SKPBYHQAMFQHRU-UHFFFAOYSA-N
Molecular Weight 306.136 g/mol
SMILES C1(=CC=CC=C1O)OC(=O)C(C(C(F)(F)F)(F)F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970443