| SpectraBase Compound ID | FcTD9yxAarv |
|---|---|
| InChI | InChI=1S/C13H8O2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H |
| InChIKey | JNELGWHKGNBSMD-UHFFFAOYSA-N |
| Mol Weight | 196.2 g/mol |
| Molecular Formula | C13H8O2 |
| Exact Mass | 196.052429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DReaueQvsxp |
|---|---|
| Name | Xanth-9-enone |
| CAS Registry Number | 90-47-1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H8O2 |
| InChI | InChI=1S/C13H8O2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H |
| InChIKey | JNELGWHKGNBSMD-UHFFFAOYSA-N |
| Literature Reference | J. Castelao, O. Gottlieb, Phytochem. 16, 735 (1977). |
| NMR Standard | CDCl3 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |