| SpectraBase Compound ID | 3swCKl8Xxwf |
|---|---|
| InChI | InChI=1S/C14H20O3/c1-4-5-6-9-17-13-8-7-12(11(2)15)10-14(13)16-3/h7-8,10H,4-6,9H2,1-3H3 |
| InChIKey | PVGGTMGSDGHIOM-UHFFFAOYSA-N |
| Mol Weight | 236.31 g/mol |
| Molecular Formula | C14H20O3 |
| Exact Mass | 236.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HGscSRBYFIB |
|---|---|
| Name | 4'-Hydroxy-3'-methoxyacetophenone, pentyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.141244501 u |
| Formula | C14H20O3 |
| InChI | InChI=1S/C14H20O3/c1-4-5-6-9-17-13-8-7-12(11(2)15)10-14(13)16-3/h7-8,10H,4-6,9H2,1-3H3 |
| InChIKey | PVGGTMGSDGHIOM-UHFFFAOYSA-N |
| Molecular Weight | 236.311 g/mol |
| SMILES | C1(=CC(OC)=C(C=C1)OCCCCC)C(=O)C |