Lactofen
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000159
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA000159 contains the MS2 mass spectrum of Lactofen with the InChIkey CONWAEURSVPLRM-UHFFFAOYSA-N.
Source: Lactofen
Chemical Info
| InChI | InChI=1S/C19H15ClF3NO7/c1-3-29-17(25)10(2)30-18(26)13-9-12(5-6-15(13)24(27)28)31-16-7-4-11(8-14(16)20)19(21,22)23/h4-10H,3H2,1-2H3 |
|---|---|
| SMILES | CCOC(=O)C(C)OC(=O)c(c1)c(N(=O)=O)ccc(Oc(c2)c(Cl)cc(c2)C(F)(F)F)1 |
| InChI Key | CONWAEURSVPLRM-UHFFFAOYSA-N |
| Molecular Formula | C19H15ClF3NO7 |
| Exact Mass | 461.049 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-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | 1100fa02-6eda-4ad4-9ba9-2fe4874035f0 |
| Package id | msbnk-waters-wa000159 |
| Resource type | HTML |
| State | active |