| SpectraBase Compound ID | 4VgcIHtEcH5 |
|---|---|
| InChI | InChI=1S/C16H15ClO2/c1-11(2)12-6-8-15(9-7-12)19-16(18)13-4-3-5-14(17)10-13/h3-11H,1-2H3 |
| InChIKey | MIEAXDYYVFWBLV-UHFFFAOYSA-N |
| Mol Weight | 274.75 g/mol |
| Molecular Formula | C16H15ClO2 |
| Exact Mass | 274.076057 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FsCjHrBW2Z0 |
|---|---|
| Name | 3-Chlorobenzoic acid, 4-isopropylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.076057421 u |
| Formula | C16H15ClO2 |
| InChI | InChI=1S/C16H15ClO2/c1-11(2)12-6-8-15(9-7-12)19-16(18)13-4-3-5-14(17)10-13/h3-11H,1-2H3 |
| InChIKey | MIEAXDYYVFWBLV-UHFFFAOYSA-N |
| Molecular Weight | 274.747 g/mol |
| SMILES | C1=C(C=C(C=C1)Cl)C(=O)OC1=CC=C(C(C)C)C=C1 |