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

*Links on SpectraBase are not permalinks.

Phenol, 3-tert-butyl-4-heptafluorobutyrloxy-

View entire compound with spectra: 1 FTIR

Phenol, 3-tert-butyl-4-heptafluorobutyrloxy-
SpectraBase Compound ID GrNfCQS0Erj
InChI InChI=1S/C14H13F7O3/c1-11(2,3)8-6-7(22)4-5-9(8)24-10(23)12(15,16)13(17,18)14(19,20)21/h4-6,22H,1-3H3
InChIKey AAMPAPBDURHWRT-UHFFFAOYSA-N
Mol Weight 362.24 g/mol
Molecular Formula C14H13F7O3
Exact Mass 362.075291 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 IxGDq6Wj9vo
Name Phenol, 3-tert-butyl-4-heptafluorobutyrloxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.075291417 u
Formula C14H13F7O3
InChI InChI=1S/C14H13F7O3/c1-11(2,3)8-6-7(22)4-5-9(8)24-10(23)12(15,16)13(17,18)14(19,20)21/h4-6,22H,1-3H3
InChIKey AAMPAPBDURHWRT-UHFFFAOYSA-N
Molecular Weight 362.244 g/mol
SMILES C1=C(C=CC(=C1C(C)(C)C)OC(C(C(C(F)(F)F)(F)F)(F)F)=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.877511