EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C5H10OS |
| Net Charge | 0 |
| Average Mass | 118.201 |
| Monoisotopic Mass | 118.04524 |
| SMILES | CSC(C)CC=O |
| InChI | InChI=1S/C5H10OS/c1-5(7-2)3-4-6/h4-5H,3H2,1-2H3 |
| InChIKey | NCBDFIPMWRKPDU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(Methylthio)butanal (CHEBI:173459) is a aldehyde (CHEBI:17478) |
| IUPAC Name |
|---|
| 3-methylsulanylbutanal |
| Manual Xrefs | Databases |
|---|---|
| 55717 | ChemSpider |
| HMDB0041491 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:16630-52-7 | ChemIDplus |