| SpectraBase Compound ID | 24oTdkcjnDX |
|---|---|
| InChI | InChI=1S/C18H18O3/c1-2-3-6-12-20-16-11-7-9-14-17(19)13-8-4-5-10-15(13)21-18(14)16/h4-5,7-11H,2-3,6,12H2,1H3 |
| InChIKey | WXXONEHXTWMHFP-UHFFFAOYSA-N |
| Mol Weight | 282.34 g/mol |
| Molecular Formula | C18H18O3 |
| Exact Mass | 282.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LljCSoVmaCl |
|---|---|
| Name | 4-Pentyloxyxanthen-9-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.125594437 u |
| Formula | C18H18O3 |
| InChI | InChI=1S/C18H18O3/c1-2-3-6-12-20-16-11-7-9-14-17(19)13-8-4-5-10-15(13)21-18(14)16/h4-5,7-11H,2-3,6,12H2,1H3 |
| InChIKey | WXXONEHXTWMHFP-UHFFFAOYSA-N |
| SMILES | C(OC1=CC=CC2=C1OC1=CC=CC=C1C2=O)CCCC |