| SpectraBase Compound ID | 3pxXQQpqe4l |
|---|---|
| InChI | InChI=1S/C8H10O2S/c1-7-4-3-5-8(6-7)11(2,9)10/h3-6H,1-2H3 |
| InChIKey | HWCMIABYHBVAJW-UHFFFAOYSA-N |
| Mol Weight | 170.23 g/mol |
| Molecular Formula | C8H10O2S |
| Exact Mass | 170.040151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FYF0ZxlIaVL |
|---|---|
| Name | BENZENE, 1-METHYL-3-(METHYLSULFONYL)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H10O2S |
| InChI | InChI=1S/C8H10O2S/c1-7-4-3-5-8(6-7)11(2,9)10/h3-6H,1-2H3 |
| InChIKey | HWCMIABYHBVAJW-UHFFFAOYSA-N |
| Instrument Name | VARIAN XL-100 |
| NMR Standard | TMS |
| Solvent | CDCL3 |