| SpectraBase Compound ID | LCQuUSjc14R |
|---|---|
| InChI | InChI=1S/C20H20O3/c21-13-5-12-20(18(22)10-4-11-19(20)23)14-16-8-3-7-15-6-1-2-9-17(15)16/h1-3,6-9,13H,4-5,10-12,14H2 |
| InChIKey | HSGUFFWZZOYTCP-UHFFFAOYSA-N |
| Mol Weight | 308.38 g/mol |
| Molecular Formula | C20H20O3 |
| Exact Mass | 308.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7fXNh75LWzL |
|---|---|
| Name | 3-(1-(Naphthalen-1-ylmethyl)-2,6-dioxocyclohexyl)propanal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.141244501 u |
| Formula | C20H20O3 |
| InChI | InChI=1S/C20H20O3/c21-13-5-12-20(18(22)10-4-11-19(20)23)14-16-8-3-7-15-6-1-2-9-17(15)16/h1-3,6-9,13H,4-5,10-12,14H2 |
| InChIKey | HSGUFFWZZOYTCP-UHFFFAOYSA-N |
| Molecular Weight | 308.377 g/mol |
| SMILES | C1(=O)CCCC(C1(CC1=CC=CC=2C1=CC=CC2)CCC=O)=O |