| SpectraBase Compound ID | LTWvWH5zNsF |
|---|---|
| InChI | InChI=1S/C14H10N2OS/c17-10-11-9-16(12-5-2-1-3-6-12)15-14(11)13-7-4-8-18-13/h1-10H |
| InChIKey | HVDFEBGVPKLCCY-UHFFFAOYSA-N |
| Mol Weight | 254.31 g/mol |
| Molecular Formula | C14H10N2OS |
| Exact Mass | 254.051384 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4C8nrP5PmTD |
|---|---|
| Name | Pyrazole-4-carboxaldehyde, 1-phenyl-3-(2-thienyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.051384123 u |
| Formula | C14H10N2OS |
| InChI | InChI=1S/C14H10N2OS/c17-10-11-9-16(12-5-2-1-3-6-12)15-14(11)13-7-4-8-18-13/h1-10H |
| InChIKey | HVDFEBGVPKLCCY-UHFFFAOYSA-N |
| Molecular Weight | 254.307 g/mol |
| SMILES | C1(=NN(C2=CC=CC=C2)C=C1C=O)C1=CC=CS1 |