![2-[4-(Trifluoromethyl)phenyl]benzoxazole](/api/spectrum/HE1lz6RrPGP/structure.png?h=300&w=458 "2-[4-(Trifluoromethyl)phenyl]benzoxazole")
| SpectraBase Compound ID | 7mbTLTIODM9 |
|---|---|
| InChI | InChI=1S/C14H8F3NO/c15-14(16,17)10-7-5-9(6-8-10)13-18-11-3-1-2-4-12(11)19-13/h1-8H |
| InChIKey | PDDRXMHBYDEJQH-UHFFFAOYSA-N |
| Mol Weight | 263.22 g/mol |
| Molecular Formula | C14H8F3NO |
| Exact Mass | 263.055798 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HE1lz6RrPGP |
|---|---|
| Name | 2-[4-(Trifluoromethyl)phenyl]benzoxazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.055798370 u |
| Formula | C14H8F3NO |
| InChI | InChI=1S/C14H8F3NO/c15-14(16,17)10-7-5-9(6-8-10)13-18-11-3-1-2-4-12(11)19-13/h1-8H |
| InChIKey | PDDRXMHBYDEJQH-UHFFFAOYSA-N |
| Molecular Weight | 263.219 g/mol |
| SMILES | C=1C=C2N=C(C3=CC=C(C=C3)C(F)(F)F)OC2=CC1 |