Dataset
mass spectrometry (MS)
Chemical Information
| InChI | InChI=1S/C10H16OS/c11-12(9-3-1-2-4-9)10-5-8(6-10)7-10/h8-9H,1-7H2 |
|---|---|
| SMILES | O=S(C12CC(C1)C2)C1CCCC1 |
| InChI Key | VNTMCSVVFAFNJR-UHFFFAOYSA-N |
| Molecular Formula | C10H16OS |
| Exact Mass | 184.298 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/VNTMCSVVFAFNJR-UHFFFAOYSA-N/CHMO0000470 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/VNTMCSVVFAFNJR-UHFFFAOYSA-N/CHMO0000470 |
| Version | |
| Author | Lukas Langer |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2023-09-19 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 168499165 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |