| SpectraBase Compound ID | 4SOPbFuRQR7 |
|---|---|
| InChI | InChI=1S/C7H12S/c1-2-4-7-5-3-6-8-7/h2,4,7H,3,5-6H2,1H3/b4-2+ |
| InChIKey | WWPFJERTOAFQFO-DUXPYHPUSA-N |
| Mol Weight | 128.23 g/mol |
| Molecular Formula | C7H12S |
| Exact Mass | 128.065972 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JeLNYqeLQjC |
|---|---|
| Name | WWPFJERTOAFQFO-DUXPYHPUSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H12S |
| InChI | InChI=1S/C7H12S/c1-2-4-7-5-3-6-8-7/h2,4,7H,3,5-6H2,1H3/b4-2+ |
| InChIKey | WWPFJERTOAFQFO-DUXPYHPUSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 128.232 g/mol |
| Source File Reference | MHKO3832 |