![N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide](/api/spectrum/C0wAktVKJby/structure.png?h=300&w=458 "N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide")
| SpectraBase Compound ID | 6Xh8lHFL9Ia |
|---|---|
| InChI | InChI=1S/C17H21N3OS/c21-16(14-9-5-2-6-10-14)18-17-20-19-15(22-17)12-11-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2,(H,18,20,21) |
| InChIKey | WRFJDVZWQOUSOI-UHFFFAOYSA-N |
| Mol Weight | 315.44 g/mol |
| Molecular Formula | C17H21N3OS |
| Exact Mass | 315.140533 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C0wAktVKJby |
|---|---|
| Name | N-[5-(2-Phenylethyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.140533481 u |
| Formula | C17H21N3OS |
| InChI | InChI=1S/C17H21N3OS/c21-16(14-9-5-2-6-10-14)18-17-20-19-15(22-17)12-11-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2,(H,18,20,21) |
| InChIKey | WRFJDVZWQOUSOI-UHFFFAOYSA-N |
| SMILES | N(C=1SC(CCC2=CC=CC=C2)=NN1)C(=O)C1CCCCC1 |