![2-Methyl-5-[2-(5-methylthiophen-2-yl)ethyl]thiophene](/api/spectrum/Fzev9bZoSHH/structure.png?h=300&w=458 "2-Methyl-5-[2-(5-methylthiophen-2-yl)ethyl]thiophene")
| SpectraBase Compound ID | K2lTVd2OTN3 |
|---|---|
| InChI | InChI=1S/C12H14S2/c1-9-3-5-11(13-9)7-8-12-6-4-10(2)14-12/h3-6H,7-8H2,1-2H3 |
| InChIKey | LIGNKWCQPOBTNC-UHFFFAOYSA-N |
| Mol Weight | 222.36 g/mol |
| Molecular Formula | C12H14S2 |
| Exact Mass | 222.053693 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Fzev9bZoSHH |
|---|---|
| Name | 2-Methyl-5-[2-(5-methylthiophen-2-yl)ethyl]thiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.053692799 u |
| Formula | C12H14S2 |
| InChI | InChI=1S/C12H14S2/c1-9-3-5-11(13-9)7-8-12-6-4-10(2)14-12/h3-6H,7-8H2,1-2H3 |
| InChIKey | LIGNKWCQPOBTNC-UHFFFAOYSA-N |
| Molecular Weight | 222.364 g/mol |
| SMILES | C(CC1=CC=C(S1)C)C1=CC=C(C)S1 |