| SpectraBase Compound ID | 4JflccGuZ0f |
|---|---|
| InChI | InChI=1S/C7H8O3S/c1-10-7(9)5-4-11-3-2-6(5)8/h4H,2-3H2,1H3 |
| InChIKey | BVMDOXHGBBKJNB-UHFFFAOYSA-N |
| Mol Weight | 172.2 g/mol |
| Molecular Formula | C7H8O3S |
| Exact Mass | 172.019415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IjLXU6F76MT |
|---|---|
| Name | 2H-THIOPYRAN-5-CARBOXYLIC ACID, 3,4-DIHYDRO-4-OXO-METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H8O3S |
| InChI | InChI=1S/C7H8O3S/c1-10-7(9)5-4-11-3-2-6(5)8/h4H,2-3H2,1H3 |
| InChIKey | BVMDOXHGBBKJNB-UHFFFAOYSA-N |
| Instrument Name | JEOL FX-100 |
| NMR Standard | TMS |
| Solvent | CDCL3 |