| SpectraBase Compound ID | Jayv2Z9Z8Sq |
|---|---|
| InChI | InChI=1S/C15H22O2/c1-6-11(4)15(16)17-14-9-13(10(2)3)8-7-12(14)5/h7-11H,6H2,1-5H3 |
| InChIKey | XNXYNZSDHGHXLD-UHFFFAOYSA-N |
| Mol Weight | 234.34 g/mol |
| Molecular Formula | C15H22O2 |
| Exact Mass | 234.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JaNBeIZaCoI |
|---|---|
| Name | 5-Isopropyl-2-methylphenyl 2-methylbutanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.161979946 u |
| Formula | C15H22O2 |
| InChI | InChI=1S/C15H22O2/c1-6-11(4)15(16)17-14-9-13(10(2)3)8-7-12(14)5/h7-11H,6H2,1-5H3 |
| InChIKey | XNXYNZSDHGHXLD-UHFFFAOYSA-N |
| Molecular Weight | 234.339 g/mol |
| SMILES | C1(=CC=C(C(=C1)OC(C(CC)C)=O)C)C(C)C |