| SpectraBase Compound ID | HGGM1D1VovS |
|---|---|
| InChI | InChI=1S/C14H12O3/c1-7-6-16-11-5-4-10-8(2)9(3)14(15)17-13(10)12(7)11/h4-6H,1-3H3 |
| InChIKey | VUJLCSIVBLQJDL-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 | 6yyurDChs4D |
|---|---|
| Name | 3,4,4'-Trimethylangelicin |
| CAS Registry Number | 91666-93-2 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C14H12O3 |
| InChI | InChI=1S/C14H12O3/c1-7-6-16-11-5-4-10-8(2)9(3)14(15)17-13(10)12(7)11/h4-6H,1-3H3 |
| InChIKey | VUJLCSIVBLQJDL-UHFFFAOYSA-N |
| Literature Reference | J. Heterocycl. Chem. 21, 235 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |