3,15-Diacetyldeoxynivalenol
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000119
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000119 contains the MS2 mass spectrum of 3,15-Diacetyldeoxynivalenol with the InChIkey RANGFOQREJPKIH-QZQWDYNDSA-N.
Source: 3,15-Diacetyldeoxynivalenol
Chemical Info
| InChI | InChI=1S/C19H24O8/c1-9-5-13-18(7-24-10(2)20,15(23)14(9)22)17(4)6-12(26-11(3)21)16(27-13)19(17)8-25-19/h5,12-13,15-16,23H,6-8H2,1-4H3/t12-,13-,15?,16-,17-,18-,19+/m1/s1 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@](C(C1=O)O)([C@]3(C[C@H]([C@H]([C@@]34CO4)O2)OC(=O)C)C)COC(=O)C |
| InChI Key | RANGFOQREJPKIH-QZQWDYNDSA-N |
| Molecular Formula | C19H24O8 |
| Exact Mass | 380.147 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 | b3514d59-931e-4044-ab00-3338afb921d4 |
| Package id | msbnk-aafc-ac000119 |
| Resource type | HTML |
| State | active |