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2-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester

View entire compound with spectra: 1 NMR

2-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester
SpectraBase Compound ID 8gVrjBIuO7g
InChI InChI=1S/C21H15F3O3/c22-21(23,24)19-9-5-4-8-18(19)20(25)27-17-12-10-16(11-13-17)26-14-15-6-2-1-3-7-15/h1-13H,14H2
InChIKey YZYOOBLSNHOABH-UHFFFAOYSA-N
Mol Weight 372.34 g/mol
Molecular Formula C21H15F3O3
Exact Mass 372.097329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6L8zuMLkVb2
Name 2-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.097328829 u
Formula C21H15F3O3
InChI InChI=1S/C21H15F3O3/c22-21(23,24)19-9-5-4-8-18(19)20(25)27-17-12-10-16(11-13-17)26-14-15-6-2-1-3-7-15/h1-13H,14H2
InChIKey YZYOOBLSNHOABH-UHFFFAOYSA-N
Molecular Weight 372.343 g/mol
SMILES C1=CC=C(C(=C1)C(OC1=CC=C(C=C1)OCC1=CC=CC=C1)=O)C(F)(F)F