| SpectraBase Compound ID | 82NCJ95m17V |
|---|---|
| InChI | InChI=1S/C15H12N2S/c1-2-7-13(8-3-1)18-15-10-5-4-9-14(15)17-12-6-11-16-17/h1-12H |
| InChIKey | AWBGVJBIZQXVLA-UHFFFAOYSA-N |
| Mol Weight | 252.33 g/mol |
| Molecular Formula | C15H12N2S |
| Exact Mass | 252.07212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 79ROJ8ajB6f |
|---|---|
| Name | 1-(2-(Phenylthio)phenyl)-1H-pyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.072119568 u |
| Formula | C15H12N2S |
| InChI | InChI=1S/C15H12N2S/c1-2-7-13(8-3-1)18-15-10-5-4-9-14(15)17-12-6-11-16-17/h1-12H |
| InChIKey | AWBGVJBIZQXVLA-UHFFFAOYSA-N |
| Molecular Weight | 252.335 g/mol |
| SMILES | C1=NN(C=C1)C=1C(=CC=CC1)SC=1C=CC=CC1 |