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Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl (2-naphthyl)methyl ester

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Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl (2-naphthyl)methyl ester
SpectraBase Compound ID 10h4X70Ict7
InChI InChI=1S/C21H18F8O4/c22-18(23)20(26,27)21(28,29)19(24,25)12-33-17(31)7-3-6-16(30)32-11-13-8-9-14-4-1-2-5-15(14)10-13/h1-2,4-5,8-10,18H,3,6-7,11-12H2
InChIKey WQRSPADQHSGMPZ-UHFFFAOYSA-N
Mol Weight 486.36 g/mol
Molecular Formula C21H18F8O4
Exact Mass 486.107734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D6ssBsmyNb1
Name Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl (2-naphthyl)methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 486.107734360 u
Formula C21H18F8O4
InChI InChI=1S/C21H18F8O4/c22-18(23)20(26,27)21(28,29)19(24,25)12-33-17(31)7-3-6-16(30)32-11-13-8-9-14-4-1-2-5-15(14)10-13/h1-2,4-5,8-10,18H,3,6-7,11-12H2
InChIKey WQRSPADQHSGMPZ-UHFFFAOYSA-N
Molecular Weight 486.358 g/mol
SMILES C(CCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OCC1=CC2=C(C=CC=C2)C=C1)=O