![2,4,9,11,16,18,23,25-Octaoxapentacyclo[24.2.2.2(5,8).2.(19,22)]hexatriaconta-5,7,12,14,19,21,26,28,29,31,33,35-dodecaene](/api/spectrum/GRP0E2OZv3B/structure.png?h=300&w=458 "2,4,9,11,16,18,23,25-Octaoxapentacyclo[24.2.2.2(5,8).2.(19,22)]hexatriaconta-5,7,12,14,19,21,26,28,29,31,33,35-dodecaene")
| SpectraBase Compound ID | CdLhQKxHOoZ |
|---|---|
| InChI | InChI=1S/C28H24O8/c1-2-22-4-3-21(1)29-17-31-23-5-7-25(8-6-23)33-19-35-27-13-15-28(16-14-27)36-20-34-26-11-9-24(10-12-26)32-18-30-22/h1-16H,17-20H2 |
| InChIKey | JAQMBSDIJZYNCE-UHFFFAOYSA-N |
| Mol Weight | 488.49 g/mol |
| Molecular Formula | C28H24O8 |
| Exact Mass | 488.147118 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GRP0E2OZv3B |
|---|---|
| Name | 2,4,9,11,16,18,23,25-Octaoxapentacyclo[24.2.2.2(5,8).2.(19,22)]hexatriaconta-5,7,12,14,19,21,26,28,29,31,33,35-dodecaene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 488.147117725 u |
| Formula | C28H24O8 |
| InChI | InChI=1S/C28H24O8/c1-2-22-4-3-21(1)29-17-31-23-5-7-25(8-6-23)33-19-35-27-13-15-28(16-14-27)36-20-34-26-11-9-24(10-12-26)32-18-30-22/h1-16H,17-20H2 |
| InChIKey | JAQMBSDIJZYNCE-UHFFFAOYSA-N |
| Molecular Weight | 488.492 g/mol |
| SMILES | C1OC2=CC=C(OCOC=3C=CC(OCOC=4C=CC(OCOC=5C=CC(O1)=CC5)=CC4)=CC3)C=C2 |