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2,2,3,3,4,4,4-Heptafluoro-N-[4-[4-(2,2,3,3,4,4,4-heptafluorobutanoylamino)phenoxy]phenyl]butanamide

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2,2,3,3,4,4,4-Heptafluoro-N-[4-[4-(2,2,3,3,4,4,4-heptafluorobutanoylamino)phenoxy]phenyl]butanamide
SpectraBase Compound ID 2Oox4CdahI2
InChI InChI=1S/C20H10F14N2O3/c21-15(22,17(25,26)19(29,30)31)13(37)35-9-1-5-11(6-2-9)39-12-7-3-10(4-8-12)36-14(38)16(23,24)18(27,28)20(32,33)34/h1-8H,(H,35,37)(H,36,38)
InChIKey KFAJHDFIPWBVRA-UHFFFAOYSA-N
Mol Weight 592.29 g/mol
Molecular Formula C20H10F14N2O3
Exact Mass 592.046786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Flf8BBPWsiU
Name 2,2,3,3,4,4,4-Heptafluoro-N-[4-[4-(2,2,3,3,4,4,4-heptafluorobutanoylamino)phenoxy]phenyl]butanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 592.046786469 u
Formula C20H10F14N2O3
InChI InChI=1S/C20H10F14N2O3/c21-15(22,17(25,26)19(29,30)31)13(37)35-9-1-5-11(6-2-9)39-12-7-3-10(4-8-12)36-14(38)16(23,24)18(27,28)20(32,33)34/h1-8H,(H,35,37)(H,36,38)
InChIKey KFAJHDFIPWBVRA-UHFFFAOYSA-N
Molecular Weight 592.289 g/mol
SMILES C1=CC(NC(C(F)(C(F)(F)C(F)(F)F)F)=O)=CC=C1OC1=CC=C(C=C1)NC(=O)C(F)(C(F)(C(F)(F)F)F)F