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Methyl (+-)-11-fluoro-10-acetoxyundecanoate
SpectraBase Compound ID Ej3OVsYrBO7
InChI InChI=1S/C14H25FO4/c1-12(16)19-11-13(15)9-7-5-3-4-6-8-10-14(17)18-2/h13H,3-11H2,1-2H3
InChIKey MZKOOVAETTWLBJ-UHFFFAOYSA-N
Mol Weight 276.35 g/mol
Molecular Formula C14H25FO4
Exact Mass 276.173687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GRhV0GLbV2T
Name Methyl (+-)-11-fluoro-10-acetoxyundecanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 276.173687444 u
Formula C14H25FO4
InChI InChI=1S/C14H25FO4/c1-12(16)19-11-13(15)9-7-5-3-4-6-8-10-14(17)18-2/h13H,3-11H2,1-2H3
InChIKey MZKOOVAETTWLBJ-UHFFFAOYSA-N
Molecular Weight 276.348 g/mol
SMILES C(=O)(OCC(F)CCCCCCCCC(=O)OC)C