Chlorothalonil TP SYN548008
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ500053
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ500053 contains the MS2 mass spectrum of Chlorothalonil TP SYN548008 with the InChIkey MTUJZIXTGNBGGD-UHFFFAOYSA-N.
Source: Chlorothalonil TP SYN548008
Chemical Info
| InChI | InChI=1S/C8H6Cl2N2O8S2/c9-3-1(7(11)13)5(21(15,16)17)4(10)6(22(18,19)20)2(3)8(12)14/h(H2,11,13)(H2,12,14)(H,15,16,17)(H,18,19,20) |
|---|---|
| SMILES | O=S(C1=C(C(N)=O)C(Cl)=C(C(N)=O)C(S(=O)(O)=O)=C1Cl)(O)=O |
| InChI Key | MTUJZIXTGNBGGD-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2N2O8S2 |
| Exact Mass | 391.894 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | ac6d5c13-0855-47ac-b23d-f5328a6b80bb |
| Package id | msbnk-eawag-eq500053 |
| Resource type | HTML |
| State | active |