| SpectraBase Compound ID | GvYDYthFlcV |
|---|---|
| InChI | InChI=1S/C13H15N3OS/c1-9(2)8-11-15-16-13(18-11)14-12(17)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,16,17) |
| InChIKey | QMINIZBKMAPSNN-UHFFFAOYSA-N |
| Mol Weight | 261.34 g/mol |
| Molecular Formula | C13H15N3OS |
| Exact Mass | 261.093583 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3W1Jx7B8SSP |
|---|---|
| Name | N-(5-Isobutyl-1,3,4-thiadiazol-2-yl)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.093583288 u |
| Formula | C13H15N3OS |
| InChI | InChI=1S/C13H15N3OS/c1-9(2)8-11-15-16-13(18-11)14-12(17)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,16,17) |
| InChIKey | QMINIZBKMAPSNN-UHFFFAOYSA-N |
| Molecular Weight | 261.343 g/mol |
| SMILES | C1=C(C=CC=C1)C(NC1=NN=C(S1)CC(C)C)=O |