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2,4-di-Tert-amylphenol, o-pentafluoropropionyl-
SpectraBase Compound ID LOyrkQN7tNX
InChI InChI=1S/C19H25F5O2/c1-7-16(3,4)12-9-10-14(13(11-12)17(5,6)8-2)26-15(25)18(20,21)19(22,23)24/h9-11H,7-8H2,1-6H3
InChIKey JFDSQJVUGMDJNN-UHFFFAOYSA-N
Mol Weight 380.4 g/mol
Molecular Formula C19H25F5O2
Exact Mass 380.177471 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5o6whNpCKjW
Name 2,4-di-Tert-amylphenol, o-pentafluoropropionyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.177470858 u
Formula C19H25F5O2
InChI InChI=1S/C19H25F5O2/c1-7-16(3,4)12-9-10-14(13(11-12)17(5,6)8-2)26-15(25)18(20,21)19(22,23)24/h9-11H,7-8H2,1-6H3
InChIKey JFDSQJVUGMDJNN-UHFFFAOYSA-N
Molecular Weight 380.399 g/mol
SMILES C(CC)(C)(C)C1=CC(C(CC)(C)C)=CC=C1OC(C(C(F)(F)F)(F)F)=O