| SpectraBase Compound ID | 8k4AGefSZD8 |
|---|---|
| InChI | InChI=1S/C20H18O6/c1-25-19(23)9-3-13-11-15(21)5-7-17(13)18-8-6-16(22)12-14(18)4-10-20(24)26-2/h3-12,21-22H,1-2H3/b9-3-,10-4+ |
| InChIKey | XEHNCCCBVIDJAM-INWPEIIHSA-N |
| Mol Weight | 354.36 g/mol |
| Molecular Formula | C20H18O6 |
| Exact Mass | 354.110338 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4dntpus6xIN |
|---|---|
| Name | PMA-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H18O6 |
| InChI | InChI=1S/C20H18O6/c1-25-19(23)9-3-13-11-15(21)5-7-17(13)18-8-6-16(22)12-14(18)4-10-20(24)26-2/h3-12,21-22H,1-2H3/b9-3-,10-4+ |
| InChIKey | XEHNCCCBVIDJAM-INWPEIIHSA-N |
| Molecular Weight | 354.358 g/mol |
| SMILES | Oc1cc(c(-c2ccc(cc2\C=C/C(=O)OC)O)cc1)\C=C\C(=O)OC |
| SPLASH | splash10-009f-9830000000-e6d294cb4896dc65c316 |
| Source of Spectrum | Y1-35-1042-9 |
| Wiley ID | 1526827 |