| SpectraBase Compound ID | EVp5SI0Wsrg |
|---|---|
| InChI | InChI=1S/C14H12O6/c1-16-10-8-6-7-4-5-19-9(7)12(17-2)11(8)20-14(15)13(10)18-3/h4-6H,1-3H3 |
| InChIKey | NGCYDEYEPDYBIX-UHFFFAOYSA-N |
| Mol Weight | 276.24 g/mol |
| Molecular Formula | C14H12O6 |
| Exact Mass | 276.063388 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EtUiGUjYEbr |
|---|---|
| Name | Isohalfordin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H12O6 |
| InChI | InChI=1S/C14H12O6/c1-16-10-8-6-7-4-5-19-9(7)12(17-2)11(8)20-14(15)13(10)18-3/h4-6H,1-3H3 |
| InChIKey | NGCYDEYEPDYBIX-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 276.244 g/mol |
| SMILES | COC=1C(=O)Oc2c(C1OC)cc1c(c2OC)occ1 |
| SPLASH | splash10-004i-0190000000-2b53e403ff2bcc4839e4 |
| Source of Spectrum | SRH-2022-3114-0 |
| Wiley ID | 1825446 |