![Tricyclo[10.2.2.2*4,7*]octadeca-1(15),4,6,12(16),13,17-hexaene-6-carbaldehyde](/api/spectrum/E4AsJSFrg9J/structure.png?h=300&w=458 "Tricyclo[10.2.2.2*4,7*]octadeca-1(15),4,6,12(16),13,17-hexaene-6-carbaldehyde")
| SpectraBase Compound ID | KvPCZiRsXV3 |
|---|---|
| InChI | InChI=1S/C19H20O/c20-14-19-13-17-10-9-16-7-5-15(6-8-16)3-1-2-4-18(19)12-11-17/h5-8,11-14H,1-4,9-10H2 |
| InChIKey | ROULBYDSPJHMOQ-UHFFFAOYSA-N |
| Mol Weight | 264.37 g/mol |
| Molecular Formula | C19H20O |
| Exact Mass | 264.151415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E4AsJSFrg9J |
|---|---|
| Name | Tricyclo[10.2.2.2*4,7*]octadeca-1(15),4,6,12(16),13,17-hexaene-6-carbaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.151415263 u |
| Formula | C19H20O |
| InChI | InChI=1S/C19H20O/c20-14-19-13-17-10-9-16-7-5-15(6-8-16)3-1-2-4-18(19)12-11-17/h5-8,11-14H,1-4,9-10H2 |
| InChIKey | ROULBYDSPJHMOQ-UHFFFAOYSA-N |
| Molecular Weight | 264.368 g/mol |
| SMILES | C1(=C2C=CC(=C1)CCC=1C=CC(CCCC2)=CC1)C=O |