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Propanoic acid, 2-(4-((5-(trifluoromethyl)-2-pyridinyl)oxy)phenoxy)-, butyl ester, (R)-
SpectraBase Compound ID J4mmXRy3J70
InChI InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1
InChIKey VAIZTNZGPYBOGF-CYBMUJFWSA-N
Mol Weight 383.37 g/mol
Molecular Formula C19H20F3NO4
Exact Mass 383.134443 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9TUZgY4IN0A
Name Propanoic acid, 2-(4-((5-(trifluoromethyl)-2-pyridinyl)oxy)phenoxy)-, butyl ester, (R)-
Comments Computed using HOSE algorithm
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Exact Mass 383.134442613 u
Formula C19H20F3NO4
InChI InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1
InChIKey VAIZTNZGPYBOGF-CYBMUJFWSA-N
Molecular Weight 383.367 g/mol
SMILES CCCCOC(=O)[C@@](C)(OC1=CC=C(OC2=NC=C(C=C2)C(F)(F)F)C=C1)[H]