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PFP-HVA

View entire compound with spectra: 2 MS (GC)

PFP-HVA
SpectraBase Compound ID IPhHQP9NMk9
InChI InChI=1S/C15H9F11O5/c1-29-8-4-6(5-9(27)31-10(13(18,19)20)14(21,22)23)2-3-7(8)30-11(28)12(16,17)15(24,25)26/h2-4,10H,5H2,1H3
InChIKey XIKXYYAIFVWTRP-UHFFFAOYSA-N
Mol Weight 478.21 g/mol
Molecular Formula C15H9F11O5
Exact Mass 478.027433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G7BacEXr81o
Name PFP-HVA
Alternate Name(s) Pentafluoropropionyl,hexafluoroisopropyl derivative of homovanillac acid 2-Methoxy-4-{2-oxo-2-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]ethyl}phenyl 2,2,3,3,3-pentafluoropropanoate Hexafluoroisopropyl (pentafluoropropionyl)homovanillate Hexafluoroisopropyl 4-(pentafluoropropionyl)-3-methoxy-phenylacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H9F11O5
InChI InChI=1S/C15H9F11O5/c1-29-8-4-6(5-9(27)31-10(13(18,19)20)14(21,22)23)2-3-7(8)30-11(28)12(16,17)15(24,25)26/h2-4,10H,5H2,1H3
InChIKey XIKXYYAIFVWTRP-UHFFFAOYSA-N
Molecular Weight 478.214 g/mol
SMILES C(C(Oc1c(cc(cc1)CC(OC(C(F)(F)F)C(F)(F)F)=O)OC)=O)(C(F)(F)F)(F)F
SPLASH splash10-003r-0073900000-f50dde16ed88db65c87b
Source of Spectrum KO-9-303-1
Wiley ID 1394618