Benzofenap
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000147
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA000147 contains the MS2 mass spectrum of Benzofenap with the InChIkey JDWQITFHZOBBFE-UHFFFAOYSA-N.
Source: Benzofenap
Chemical Info
| InChI | InChI=1S/C22H20Cl2N2O3/c1-12-5-7-15(8-6-12)18(27)11-29-22-19(14(3)25-26(22)4)21(28)16-9-10-17(23)13(2)20(16)24/h5-10H,11H2,1-4H3 |
|---|---|
| SMILES | Cc(c3)ccc(c3)C(=O)COc(n(C)2)c(c(C)n2)C(=O)c(c1)c(Cl)c(C)c(Cl)c1 |
| InChI Key | JDWQITFHZOBBFE-UHFFFAOYSA-N |
| Molecular Formula | C22H20Cl2N2O3 |
| Exact Mass | 430.085 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 | 5a5a9aa9-c51e-48b9-bf9c-e5ecb1493e60 |
| Package id | msbnk-waters-wa000147 |
| Resource type | HTML |
| State | active |