| SpectraBase Compound ID | 3Cv69FT4VI1 |
|---|---|
| InChI | InChI=1S/C14H12O3/c1-7-5-12(15)17-14-10(7)4-8(2)13-11(14)6-9(3)16-13/h4-6H,1-3H3 |
| InChIKey | QZOAPTQNJLZENV-UHFFFAOYSA-N |
| Mol Weight | 228.25 g/mol |
| Molecular Formula | C14H12O3 |
| Exact Mass | 228.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E5CuauCbjdH |
|---|---|
| Name | 4,6,5'-Trimethylangelicin |
| CAS Registry Number | 90370-12-0 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C14H12O3 |
| InChI | InChI=1S/C14H12O3/c1-7-5-12(15)17-14-10(7)4-8(2)13-11(14)6-9(3)16-13/h4-6H,1-3H3 |
| InChIKey | QZOAPTQNJLZENV-UHFFFAOYSA-N |
| Literature Reference | J. Heterocycl. Chem. 21, 235 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |