| SpectraBase Compound ID | Dh4QNo992tx |
|---|---|
| InChI | InChI=1S/C17H22O4/c1-2-12-20-16(18)14-10-6-7-11-15(14)17(19)21-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3 |
| InChIKey | OZBBXRCZRHVFTK-UHFFFAOYSA-N |
| Mol Weight | 290.36 g/mol |
| Molecular Formula | C17H22O4 |
| Exact Mass | 290.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7RpMysamVJO |
|---|---|
| Name | Phthalic acid, cyclohexyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.151809184 u |
| Formula | C17H22O4 |
| InChI | InChI=1S/C17H22O4/c1-2-12-20-16(18)14-10-6-7-11-15(14)17(19)21-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3 |
| InChIKey | OZBBXRCZRHVFTK-UHFFFAOYSA-N |
| SMILES | C(C1=C(C=CC=C1)C(OC1CCCCC1)=O)(OCCC)=O |