![2-p-Tolyl-5-[trichloromethyl]-1,3,4-oxadiazole](/api/spectrum/2ADsPWqBhjG/structure.png?h=300&w=458 "2-p-Tolyl-5-[trichloromethyl]-1,3,4-oxadiazole")
| SpectraBase Compound ID | 8Gu5LO1Sld6 |
|---|---|
| InChI | InChI=1S/C10H7Cl3N2O/c1-6-2-4-7(5-3-6)8-14-15-9(16-8)10(11,12)13/h2-5H,1H3 |
| InChIKey | SKJLFEMIXBOXBG-UHFFFAOYSA-N |
| Mol Weight | 277.54 g/mol |
| Molecular Formula | C10H7Cl3N2O |
| Exact Mass | 275.962396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ADsPWqBhjG |
|---|---|
| Name | 2-p-Tolyl-5-[trichloromethyl]-1,3,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.962395952 u |
| Formula | C10H7Cl3N2O |
| InChI | InChI=1S/C10H7Cl3N2O/c1-6-2-4-7(5-3-6)8-14-15-9(16-8)10(11,12)13/h2-5H,1H3 |
| InChIKey | SKJLFEMIXBOXBG-UHFFFAOYSA-N |
| SMILES | CC1=CC=C(C=C1)C1=NN=C(C(Cl)(Cl)Cl)O1 |