| SpectraBase Compound ID | 730iTpKh64x |
|---|---|
| InChI | InChI=1S/C7H8S/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3 |
| InChIKey | WRXOZRLZDJAYDR-UHFFFAOYSA-N |
| Mol Weight | 124.2 g/mol |
| Molecular Formula | C7H8S |
| Exact Mass | 124.034671 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | HCGZPJYIXuJ |
|---|---|
| Name | 3-Methylbenzenethiol |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | T28517 |
| CAS Registry Number | 108-40-7 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H8S |
| InChI | InChI=1S/C7H8S/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3 |
| InChIKey | WRXOZRLZDJAYDR-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 95% |
| Solvent | CDCl3 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | m-Thiocresol |
| Wiley ID | SIAL_13CNMR_012806 |