| SpectraBase Compound ID | 5aDZT6fYdKY |
|---|---|
| InChI | InChI=1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2 |
| InChIKey | ZRWPUFFVAOMMNM-UHFFFAOYSA-N |
| Mol Weight | 154.12 g/mol |
| Molecular Formula | C7H6O4 |
| Exact Mass | 154.026609 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Bgh5jBOxfvL |
|---|---|
| Name | Patulin |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
| Formula | C7H6O4 |
| InChI | InChI=1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2 |
| InChIKey | ZRWPUFFVAOMMNM-UHFFFAOYSA-N |
| SMILES | OC1C=2C(=CCO1)OC(C2)=O |
| SPLASH | splash10-1159-9500000000-6b47ec29d871dc450d86 |
| Source of Spectrum | Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |