| SpectraBase Compound ID | 63g8djJZNkm |
|---|---|
| InChI | InChI=1S/C14H12N4S/c19-14-17-16-13(15-11-7-3-1-4-8-11)18(14)12-9-5-2-6-10-12/h1-10H,(H,15,16)(H,17,19) |
| InChIKey | ADVANMXLTWBUFC-UHFFFAOYSA-N |
| Mol Weight | 268.34 g/mol |
| Molecular Formula | C14H12N4S |
| Exact Mass | 268.078268 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1bzhnHVsa3x |
|---|---|
| Name | 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-phenyl-5-(phenylamino)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.078267576 u |
| Formula | C14H12N4S |
| InChI | InChI=1S/C14H12N4S/c19-14-17-16-13(15-11-7-3-1-4-8-11)18(14)12-9-5-2-6-10-12/h1-10H,(H,15,16)(H,17,19) |
| InChIKey | ADVANMXLTWBUFC-UHFFFAOYSA-N |
| Molecular Weight | 268.338 g/mol |
| SMILES | C=1(N(C(=S)NN1)C1=CC=CC=C1)NC=1C=CC=CC1 |