Patulin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000650
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000650 contains the MS2 mass spectrum of Patulin with the InChIkey ZRWPUFFVAOMMNM-UHFFFAOYSA-N.
Source: Patulin
Chemical Info
| InChI | InChI=1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2 |
|---|---|
| SMILES | C1C=C2C(=CC(=O)O2)C(O1)O |
| InChI Key | ZRWPUFFVAOMMNM-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
| Exact Mass | 154.027 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 | 0ac7889e-a451-421e-bbdb-70ed5ec53eab |
| Package id | msbnk-aafc-ac000650 |
| Resource type | HTML |
| State | active |