![Thiophene, 2-[(4-methoxyphenyl)methyl]-](/api/spectrum/EpMZFMSLeQk/structure.png?h=300&w=458 "Thiophene, 2-[(4-methoxyphenyl)methyl]-")
| SpectraBase Compound ID | 19TmDyXAM5Z |
|---|---|
| InChI | InChI=1S/C12H12OS/c1-13-11-6-4-10(5-7-11)9-12-3-2-8-14-12/h2-8H,9H2,1H3 |
| InChIKey | SMSIVWKELINLIA-UHFFFAOYSA-N |
| Mol Weight | 204.29 g/mol |
| Molecular Formula | C12H12OS |
| Exact Mass | 204.060886 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EpMZFMSLeQk |
|---|---|
| Name | Thiophene, 2-[(4-methoxyphenyl)methyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.060886179 u |
| Formula | C12H12OS |
| InChI | InChI=1S/C12H12OS/c1-13-11-6-4-10(5-7-11)9-12-3-2-8-14-12/h2-8H,9H2,1H3 |
| InChIKey | SMSIVWKELINLIA-UHFFFAOYSA-N |
| Molecular Weight | 204.287 g/mol |
| SMILES | C=1(SC=CC1)CC=1C=CC(=CC1)OC |