Phosalone
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ00347307
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ00347307 contains the MS2 mass spectrum of Phosalone with the InChIkey IOUNQDKNJZEDEP-UHFFFAOYSA-N.
Source: Phosalone
Chemical Info
| InChI | InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3 |
|---|---|
| SMILES | CCOP(=S)(OCC)SCN1C2=C(C=C(C=C2)Cl)OC1=O |
| InChI Key | IOUNQDKNJZEDEP-UHFFFAOYSA-N |
| Molecular Formula | C12H15ClNO4PS2 |
| Exact Mass | 366.987 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 9, 2025 |
| Metadata last updated | February 9, 2025 |
| Created | February 9, 2025 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | c3058c65-bd5c-467e-a9aa-f2e1fc06a25a |
| Package id | msbnk-eawag-eq00347307 |
| Resource type | HTML |
| State | active |