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Glutaric acid, 2,2,3,3-tetrafluoropropyl 3-nitrophenyl ester
SpectraBase Compound ID Fzy5GpDZ9N9
InChI InChI=1S/C14H13F4NO6/c15-13(16)14(17,18)8-24-11(20)5-2-6-12(21)25-10-4-1-3-9(7-10)19(22)23/h1,3-4,7,13H,2,5-6,8H2
InChIKey ZKMBJKINQRGOCV-UHFFFAOYSA-N
Mol Weight 367.25 g/mol
Molecular Formula C14H13F4NO6
Exact Mass 367.0679 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6dkMwzV3CzG
Name Glutaric acid, 2,2,3,3-tetrafluoropropyl 3-nitrophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 367.067899789 u
Formula C14H13F4NO6
InChI InChI=1S/C14H13F4NO6/c15-13(16)14(17,18)8-24-11(20)5-2-6-12(21)25-10-4-1-3-9(7-10)19(22)23/h1,3-4,7,13H,2,5-6,8H2
InChIKey ZKMBJKINQRGOCV-UHFFFAOYSA-N
Molecular Weight 367.253 g/mol
SMILES C(CCC(OCC(C(F)F)(F)F)=O)C(OC1=CC=CC(=C1)N(=O)=O)=O