Dataset
Cadusafos; LC-ESI-QFT; MS2; CE: 15%; R=17500; [M+H]+
Chemical Information
| InChI | InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3 |
|---|---|
| SMILES | CCC(C)SP(=O)(OCC)SC(C)CC |
| InChI Key | KXRPCFINVWWFHQ-UHFFFAOYSA-N |
| Molecular Formula | C10H23O2PS2 |
| Exact Mass | 270.088 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01121201 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2023-04-27 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEBI:38588 | chebi |
| CHEMBL2228571 | chembl |
| 63059 | surechembl |
| 91752 | pubchem |
| 8JBJ4VO75K | fdasrs |
| 233796 | brenda |
| HMDB0249530 | hmdb |
| The data in this table is sourced from UniChem at EBI. | |