| SpectraBase Compound ID | 1cUB7rYVgdt |
|---|---|
| InChI | InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12-,18+/m0/s1 |
| InChIKey | NIDRYBLTWYFCFV-OAVHHTNSSA-N |
| Mol Weight | 370.45 g/mol |
| Molecular Formula | C22H26O5 |
| Exact Mass | 370.178024 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 61Tlyahj7BA |
|---|---|
| Name | CALANOLIDE-A |
| Compound Number | 14 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12-,18+/m0/s1 |
| InChIKey | NIDRYBLTWYFCFV-OAVHHTNSSA-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 |