| SpectraBase Compound ID | ELIayoTiJRg |
|---|---|
| InChI | InChI=1S/C11H10S/c1-9-2-4-10(5-3-9)11-6-7-12-8-11/h2-8H,1H3 |
| InChIKey | HNCPAJPMBWXHEH-UHFFFAOYSA-N |
| Mol Weight | 174.26 g/mol |
| Molecular Formula | C11H10S |
| Exact Mass | 174.050321 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KQ4bJ6Ugl4h |
|---|---|
| Name | Thiophen, 3-(4-methylphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.050321496 u |
| Formula | C11H10S |
| InChI | InChI=1S/C11H10S/c1-9-2-4-10(5-3-9)11-6-7-12-8-11/h2-8H,1H3 |
| InChIKey | HNCPAJPMBWXHEH-UHFFFAOYSA-N |
| Molecular Weight | 174.261 g/mol |
| SMILES | CC1=CC=C(C=C1)C=1C=CSC1 |