| SpectraBase Compound ID | 19oU5ipvroL |
|---|---|
| InChI | InChI=1S/C17H12N2S/c18-11-14-15(12-7-3-1-4-8-12)16(20-17(14)19)13-9-5-2-6-10-13/h1-10H,19H2 |
| InChIKey | VYFODMBLWWGUOU-UHFFFAOYSA-N |
| Mol Weight | 276.36 g/mol |
| Molecular Formula | C17H12N2S |
| Exact Mass | 276.07212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C6RmNWsASSa |
|---|---|
| Name | 2-Amino-3-cyano-4,5-diphenylthiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.072119568 u |
| Formula | C17H12N2S |
| InChI | InChI=1S/C17H12N2S/c18-11-14-15(12-7-3-1-4-8-12)16(20-17(14)19)13-9-5-2-6-10-13/h1-10H,19H2 |
| InChIKey | VYFODMBLWWGUOU-UHFFFAOYSA-N |
| Molecular Weight | 276.357 g/mol |
| SMILES | C1(=C(SC(=C1C1=CC=CC=C1)C1=CC=CC=C1)N)C#N |