EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C5H12S |
| Net Charge | 0 |
| Average Mass | 104.218 |
| Monoisotopic Mass | 104.06597 |
| SMILES | CCCCCS |
| InChI | InChI=1S/C5H12S/c1-2-3-4-5-6/h6H,2-5H2,1H3 |
| InChIKey | ZRKMQKLGEQPLNS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-Pentanethiol (CHEBI:173322) is a alkanethiol (CHEBI:47908) |
| IUPAC Name |
|---|
| pentane-1-thiol |
| Manual Xrefs | Databases |
|---|---|
| 7776 | ChemSpider |
| HMDB0032457 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:110-66-7 | ChemIDplus |