| SpectraBase Compound ID | LsasSeUFDYl |
|---|---|
| InChI | InChI=1S/C15H13N3S/c1-3-7-12(8-4-1)11-14-17-18-15(19-14)16-13-9-5-2-6-10-13/h1-10H,11H2,(H,16,18) |
| InChIKey | AGJGEZUUEYZNOA-UHFFFAOYSA-N |
| Mol Weight | 267.35 g/mol |
| Molecular Formula | C15H13N3S |
| Exact Mass | 267.083019 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3u6bf3x0WeL |
|---|---|
| Name | 5-Benzyl-N-phenyl-1,3,4-thiadiazol-2-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.083018605 u |
| Formula | C15H13N3S |
| InChI | InChI=1S/C15H13N3S/c1-3-7-12(8-4-1)11-14-17-18-15(19-14)16-13-9-5-2-6-10-13/h1-10H,11H2,(H,16,18) |
| InChIKey | AGJGEZUUEYZNOA-UHFFFAOYSA-N |
| Molecular Weight | 267.350 g/mol |
| SMILES | C(C=1SC(NC2=CC=CC=C2)=NN1)C1=CC=CC=C1 |