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Nonyl heptafluorobutyrate
SpectraBase Compound ID LRGIgwh0a5J
InChI InChI=1S/C13H19F7O2/c1-2-3-4-5-6-7-8-9-22-10(21)11(14,15)12(16,17)13(18,19)20/h2-9H2,1H3
InChIKey KKMYDVWFFLRAAN-UHFFFAOYSA-N
Mol Weight 340.28 g/mol
Molecular Formula C13H19F7O2
Exact Mass 340.127327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtucJD76GRA
Name Nonyl heptafluorobutyrate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.127326991 u
Formula C13H19F7O2
InChI InChI=1S/C13H19F7O2/c1-2-3-4-5-6-7-8-9-22-10(21)11(14,15)12(16,17)13(18,19)20/h2-9H2,1H3
InChIKey KKMYDVWFFLRAAN-UHFFFAOYSA-N
Molecular Weight 340.282 g/mol
SMILES C(CCCCCCCC)OC(=O)C(C(C(F)(F)F)(F)F)(F)F