Aflatoxin B1
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000022
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000022 contains the MS2 mass spectrum of Aflatoxin B1 with the InChIkey OQIQSTLJSLGHID-WNWIJWBNSA-N.
Source: Aflatoxin B1
Chemical Info
| InChI | InChI=1S/C17H12O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h4-6,8,17H,2-3H2,1H3/t8-,17+/m0/s1 |
|---|---|
| SMILES | COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4[C@@H]5C=CO[C@@H]5OC4=C1 |
| InChI Key | OQIQSTLJSLGHID-WNWIJWBNSA-N |
| Molecular Formula | C17H12O6 |
| Exact Mass | 312.063 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 | 4be958d9-a3c5-4d78-bd2c-11c858b58272 |
| Package id | msbnk-aafc-ac000022 |
| Resource type | HTML |
| State | active |