| SpectraBase Compound ID | LMtxe0kMMTw |
|---|---|
| InChI | InChI=1S/C14H20O3/c1-10(2)7-8-17-13-6-5-12(11(3)15)9-14(13)16-4/h5-6,9-10H,7-8H2,1-4H3 |
| InChIKey | SZTDWEVOYCSIQB-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 | GGx1ZL7sAmU |
|---|---|
| Name | 4'-Hydroxy-3'-methoxyacetophenone, 3-methylbutyl 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/c1-10(2)7-8-17-13-6-5-12(11(3)15)9-14(13)16-4/h5-6,9-10H,7-8H2,1-4H3 |
| InChIKey | SZTDWEVOYCSIQB-UHFFFAOYSA-N |
| Molecular Weight | 236.311 g/mol |
| SMILES | C1(=CC(OC)=C(C=C1)OCCC(C)C)C(=O)C |