![3-methylbenzo[b]thiophene-2-acetic acid, methyl ester](/api/spectrum/4oKPYXqTopC/structure.png?h=300&w=458 "3-methylbenzo[b]thiophene-2-acetic acid, methyl ester")
| SpectraBase Compound ID | J1ISah17NeN |
|---|---|
| InChI | InChI=1S/C12H12O2S/c1-8-9-5-3-4-6-10(9)15-11(8)7-12(13)14-2/h3-6H,7H2,1-2H3 |
| InChIKey | SEZNWCZPNPVCCJ-UHFFFAOYSA-N |
| Mol Weight | 220.29 g/mol |
| Molecular Formula | C12H12O2S |
| Exact Mass | 220.055801 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4oKPYXqTopC |
|---|---|
| Name | 3-methylbenzo[b]thiophene-2-acetic acid, methyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O2S |
| InChI | InChI=1S/C12H12O2S/c1-8-9-5-3-4-6-10(9)15-11(8)7-12(13)14-2/h3-6H,7H2,1-2H3 |
| InChIKey | SEZNWCZPNPVCCJ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48831M |
| Solvent | CDCl3 |