Mandestrobin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01138009
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ01138009 contains the MS2 mass spectrum of Mandestrobin with the InChIkey PDPWCKVFIFAQIQ-UHFFFAOYSA-N.
Source: Mandestrobin
Chemical Info
| InChI | InChI=1S/C19H23NO3/c1-13-9-10-14(2)17(11-13)23-12-15-7-5-6-8-16(15)18(22-4)19(21)20-3/h5-11,18H,12H2,1-4H3,(H,20,21) |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(C(=O)NC)OC |
| InChI Key | PDPWCKVFIFAQIQ-UHFFFAOYSA-N |
| Molecular Formula | C19H23NO3 |
| Exact Mass | 313.168 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 | e8bc622b-6a59-49e7-a4fc-de83c8267db3 |
| Package id | msbnk-eawag-eq01138009 |
| Resource type | HTML |
| State | active |