| SpectraBase Compound ID | DCjFSpaUtHa |
|---|---|
| InChI | InChI=1S/C7H8O3S/c1-4(8)6-5(7(9)10)2-3-11-6/h2-4,8H,1H3,(H,9,10) |
| InChIKey | USOICVDDDAHNEV-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 | LoGXHzRk1YI |
|---|---|
| Name | USOICVDDDAHNEV-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H8O3S |
| InChI | InChI=1S/C7H8O3S/c1-4(8)6-5(7(9)10)2-3-11-6/h2-4,8H,1H3,(H,9,10) |
| InChIKey | USOICVDDDAHNEV-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 172.199 g/mol |
| Source File Reference | MHKO9868 |