| SpectraBase Compound ID | DKJRWjajR1J |
|---|---|
| InChI | InChI=1S/C15H22O3/c1-11(2)9-17-14-8-6-5-7-13(14)15(16)18-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3 |
| InChIKey | UZSNBSUJIHOFAF-UHFFFAOYSA-N |
| Mol Weight | 250.34 g/mol |
| Molecular Formula | C15H22O3 |
| Exact Mass | 250.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8bqOPjnemxH |
|---|---|
| Name | Salicylic acid, 2-methylpropyl ether, 2-methylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.156894565 u |
| Formula | C15H22O3 |
| InChI | InChI=1S/C15H22O3/c1-11(2)9-17-14-8-6-5-7-13(14)15(16)18-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3 |
| InChIKey | UZSNBSUJIHOFAF-UHFFFAOYSA-N |
| Molecular Weight | 250.338 g/mol |
| SMILES | C1(=CC=CC=C1C(OCC(C)C)=O)OCC(C)C |