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4-Hydroxybenzyl alcohol, bis(heptafluorobutyrate)

View entire compound with spectra: 1 NMR

4-Hydroxybenzyl alcohol, bis(heptafluorobutyrate)
SpectraBase Compound ID 7qot7cff83g
InChI InChI=1S/C15H6F14O4/c16-10(17,12(20,21)14(24,25)26)8(30)32-5-6-1-3-7(4-2-6)33-9(31)11(18,19)13(22,23)15(27,28)29/h1-4H,5H2
InChIKey FGALMUVNHSMOSX-UHFFFAOYSA-N
Mol Weight 516.19 g/mol
Molecular Formula C15H6F14O4
Exact Mass 516.004253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ec60KniPvu
Name 4-Hydroxybenzyl alcohol, bis(heptafluorobutyrate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 516.004252951 u
Formula C15H6F14O4
InChI InChI=1S/C15H6F14O4/c16-10(17,12(20,21)14(24,25)26)8(30)32-5-6-1-3-7(4-2-6)33-9(31)11(18,19)13(22,23)15(27,28)29/h1-4H,5H2
InChIKey FGALMUVNHSMOSX-UHFFFAOYSA-N
Molecular Weight 516.187 g/mol
SMILES C1=CC(=CC=C1COC(=O)C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F