| SpectraBase Compound ID | 2D722v3cdaj |
|---|---|
| InChI | InChI=1S/C7H7NO3S/c1-12(11)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3 |
| InChIKey | MLTFFVSGGPGNSP-UHFFFAOYSA-N |
| Mol Weight | 185.2 g/mol |
| Molecular Formula | C7H7NO3S |
| Exact Mass | 185.014664 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ityf4xZBz1Z |
|---|---|
| Name | MLTFFVSGGPGNSP-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H7NO3S |
| InChI | InChI=1S/C7H7NO3S/c1-12(11)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3 |
| InChIKey | MLTFFVSGGPGNSP-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 185.197 g/mol |
| Source File Reference | MHKO7721 |