![2-[(4'-Methylbiphenyl-4-yl)methyl]thiophene](/api/spectrum/I1SAmcuMS7w/structure.png?h=300&w=458 "2-[(4'-Methylbiphenyl-4-yl)methyl]thiophene")
| SpectraBase Compound ID | 8tzYHqPPBDg |
|---|---|
| InChI | InChI=1S/C18H16S/c1-14-4-8-16(9-5-14)17-10-6-15(7-11-17)13-18-3-2-12-19-18/h2-12H,13H2,1H3 |
| InChIKey | GZMAJZHNUYMBBG-UHFFFAOYSA-N |
| Mol Weight | 264.39 g/mol |
| Molecular Formula | C18H16S |
| Exact Mass | 264.097272 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I1SAmcuMS7w |
|---|---|
| Name | 2-[(4'-Methylbiphenyl-4-yl)methyl]thiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.097271689 u |
| Formula | C18H16S |
| InChI | InChI=1S/C18H16S/c1-14-4-8-16(9-5-14)17-10-6-15(7-11-17)13-18-3-2-12-19-18/h2-12H,13H2,1H3 |
| InChIKey | GZMAJZHNUYMBBG-UHFFFAOYSA-N |
| Molecular Weight | 264.386 g/mol |
| SMILES | C1(=CC=CS1)CC=1C=CC(=CC1)C=1C=CC(=CC1)C |