| SpectraBase Compound ID | KQoNxpUWWyC |
|---|---|
| InChI | InChI=1S/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H3 |
| InChIKey | VCMMXZQDRFWYSE-UHFFFAOYSA-N |
| Mol Weight | 188.18 g/mol |
| Molecular Formula | C11H8O3 |
| Exact Mass | 188.047344 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LJPMRnqRNyD |
|---|---|
| Name | PLUMBAGIN |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H8O3 |
| InChI | InChI=1S/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H3 |
| InChIKey | VCMMXZQDRFWYSE-UHFFFAOYSA-N |
| Molecular Weight | 188.0471 |
| SMILES | Oc1cccc2C(C(C)=CC(=O)c12)=O |
| SPLASH | splash10-0080-5900000000-a4ec55ac1be8eabedc07 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |