Aflatoxin M1
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000049
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000049 contains the MS2 mass spectrum of Aflatoxin M1 with the InChIkey MJBWDEQAUQTVKK-IAGOWNOFSA-N.
Source: Aflatoxin M1
Chemical Info
| InChI | InChI=1S/C17H12O7/c1-21-9-6-10-13(17(20)4-5-22-16(17)23-10)14-12(9)7-2-3-8(18)11(7)15(19)24-14/h4-6,16,20H,2-3H2,1H3/t16-,17-/m1/s1 |
|---|---|
| SMILES | COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C(=C1)O[C@@H]5[C@]4(C=CO5)O |
| InChI Key | MJBWDEQAUQTVKK-IAGOWNOFSA-N |
| Molecular Formula | C17H12O7 |
| Exact Mass | 328.058 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 | f9f6d075-4aa1-4b9c-bb95-0b33d8eb0896 |
| Package id | msbnk-aafc-ac000049 |
| Resource type | HTML |
| State | active |