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

*Links on SpectraBase are not permalinks.

2-sec-Butylphenol, o-heptafluorobutyryl-

View entire compound with spectra: 1 FTIR

2-sec-Butylphenol, o-heptafluorobutyryl-
SpectraBase Compound ID 3lqTMKBUoJB
InChI InChI=1S/C14H13F7O2/c1-3-8(2)9-6-4-5-7-10(9)23-11(22)12(15,16)13(17,18)14(19,20)21/h4-8H,3H2,1-2H3
InChIKey KQOGBUVWCMSKTI-UHFFFAOYSA-N
Mol Weight 346.24 g/mol
Molecular Formula C14H13F7O2
Exact Mass 346.080377 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 EtZgt5idHV8
Name 2-sec-Butylphenol, o-heptafluorobutyryl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.080376798 u
Formula C14H13F7O2
InChI InChI=1S/C14H13F7O2/c1-3-8(2)9-6-4-5-7-10(9)23-11(22)12(15,16)13(17,18)14(19,20)21/h4-8H,3H2,1-2H3
InChIKey KQOGBUVWCMSKTI-UHFFFAOYSA-N
Molecular Weight 346.245 g/mol
SMILES C(CC)(C)C1=C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.942843