| SpectraBase Compound ID | CTgjv1lSZel |
|---|---|
| InChI | InChI=1S/C14H18O3/c1-16-10-17-13-7-5-11(6-8-13)9-12-3-2-4-14(12)15/h5-8,12H,2-4,9-10H2,1H3 |
| InChIKey | PSXSSZVKPRRLOU-UHFFFAOYSA-N |
| Mol Weight | 234.29 g/mol |
| Molecular Formula | C14H18O3 |
| Exact Mass | 234.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7O8FYLtZ4yK |
|---|---|
| Name | 2-(4-Methoxymethoxybenzyl)-1-cyclopentanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.125594437 u |
| Formula | C14H18O3 |
| InChI | InChI=1S/C14H18O3/c1-16-10-17-13-7-5-11(6-8-13)9-12-3-2-4-14(12)15/h5-8,12H,2-4,9-10H2,1H3 |
| InChIKey | PSXSSZVKPRRLOU-UHFFFAOYSA-N |
| Molecular Weight | 234.295 g/mol |
| SMILES | C1(C(CC=2C=CC(=CC2)OCOC)CCC1)=O |