| SpectraBase Compound ID | 6IB0VJhWs3y |
|---|---|
| InChI | InChI=1S/C21H22O5/c1-7-11(2)17(23)16-18(24-6)13-8-9-21(4,5)26-19(13)15-12(3)10-14(22)25-20(15)16/h7-10H,1-6H3/b11-7+ |
| InChIKey | MBFFYFBHNRLSMO-YRNVUSSQSA-N |
| Mol Weight | 354.4 g/mol |
| Molecular Formula | C21H22O5 |
| Exact Mass | 354.146724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BVp4dywyN7A |
|---|---|
| Name | COUMARIN |
| Compound Number | 51 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C21H22O5/c1-7-11(2)17(23)16-18(24-6)13-8-9-21(4,5)26-19(13)15-12(3)10-14(22)25-20(15)16/h7-10H,1-6H3/b11-7+ |
| InChIKey | MBFFYFBHNRLSMO-YRNVUSSQSA-N |
| Literature Reference | C.J.PALMER,J.L.JOSEPHS J.CHEM.SOC.PERKIN-1,3135(1995) |
| Solvent | Chloroform-d |
| Technique | APT, DEPT, INEPT; C/H SHIFT CORRELATION |