| SpectraBase Compound ID | 7P6M44Fc3Uz |
|---|---|
| InChI | InChI=1S/C14H20O3/c1-4-5-10-16-14(15)17-13-8-6-12(7-9-13)11(2)3/h6-9,11H,4-5,10H2,1-3H3 |
| InChIKey | GFKXGKSCMFFUEI-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 | DCNOonThvQK |
|---|---|
| Name | Carbonic acid, butyl 4-isopropylphenyl ester |
| 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/c1-4-5-10-16-14(15)17-13-8-6-12(7-9-13)11(2)3/h6-9,11H,4-5,10H2,1-3H3 |
| InChIKey | GFKXGKSCMFFUEI-UHFFFAOYSA-N |
| Molecular Weight | 236.311 g/mol |
| SMILES | C(OCCCC)(=O)OC1=CC=C(C(C)C)C=C1 |