| SpectraBase Compound ID | 85eZyouywyD |
|---|---|
| InChI | InChI=1S/C24H16S3/c1-3-8-17(9-4-1)19-13-15-26-23(19)22-16-20(18-10-5-2-6-11-18)24(27-22)21-12-7-14-25-21/h1-16H |
| InChIKey | MZZRGQFXLXGUES-UHFFFAOYSA-N |
| Mol Weight | 400.57 g/mol |
| Molecular Formula | C24H16S3 |
| Exact Mass | 400.041414 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LDJ8Cr8fTO7 |
|---|---|
| Name | 3,4'-Diphenyl-2,2':5',2''-terthiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 400.041414037 u |
| Formula | C24H16S3 |
| InChI | InChI=1S/C24H16S3/c1-3-8-17(9-4-1)19-13-15-26-23(19)22-16-20(18-10-5-2-6-11-18)24(27-22)21-12-7-14-25-21/h1-16H |
| InChIKey | MZZRGQFXLXGUES-UHFFFAOYSA-N |
| Molecular Weight | 400.572 g/mol |
| SMILES | C1(=C(C=CS1)C=1C=CC=CC1)C1=CC(=C(S1)C1=CC=CS1)C=1C=CC=CC1 |