| SpectraBase Compound ID | 8QJzFu4ohvU |
|---|---|
| InChI | InChI=1S/C23H37ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-26-23(25)20-21-15-17-22(24)18-16-21/h15-18H,2-14,19-20H2,1H3 |
| InChIKey | RIBKIEWMPDYZQU-UHFFFAOYSA-N |
| Mol Weight | 381.0 g/mol |
| Molecular Formula | C23H37ClO2 |
| Exact Mass | 380.248208 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3GkH6nitTE2 |
|---|---|
| Name | Phenylacetic acid, 4-chloro-, pentadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 380.248208129 u |
| Formula | C23H37ClO2 |
| InChI | InChI=1S/C23H37ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-26-23(25)20-21-15-17-22(24)18-16-21/h15-18H,2-14,19-20H2,1H3 |
| InChIKey | RIBKIEWMPDYZQU-UHFFFAOYSA-N |
| Molecular Weight | 381.000 g/mol |
| SMILES | C(OCCCCCCCCCCCCCCC)(CC1=CC=C(C=C1)Cl)=O |