| SpectraBase Compound ID | FD9USNX60cF |
|---|---|
| InChI | InChI=1S/C13H18O3/c1-3-4-5-8-16-13-9-12(15-2)7-6-11(13)10-14/h6-7,9-10H,3-5,8H2,1-2H3 |
| InChIKey | HHKQGMUKYNDPMP-UHFFFAOYSA-N |
| Mol Weight | 222.28 g/mol |
| Molecular Formula | C13H18O3 |
| Exact Mass | 222.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IqmJgJ859W8 |
|---|---|
| Name | 2-Hydroxy-4-methoxybenzaldehyde, pentyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.125594437 u |
| Formula | C13H18O3 |
| InChI | InChI=1S/C13H18O3/c1-3-4-5-8-16-13-9-12(15-2)7-6-11(13)10-14/h6-7,9-10H,3-5,8H2,1-2H3 |
| InChIKey | HHKQGMUKYNDPMP-UHFFFAOYSA-N |
| Molecular Weight | 222.284 g/mol |
| SMILES | C1(=C(C=CC(=C1)OC)C=O)OCCCCC |