| SpectraBase Compound ID | KbMoLB0swkP |
|---|---|
| InChI | InChI=1S/C13H17ClO2/c1-2-3-10-16-13(15)9-6-11-4-7-12(14)8-5-11/h4-5,7-8H,2-3,6,9-10H2,1H3 |
| InChIKey | WPNNTKDTAKBZNO-UHFFFAOYSA-N |
| Mol Weight | 240.73 g/mol |
| Molecular Formula | C13H17ClO2 |
| Exact Mass | 240.091707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KSJeGqmsdXd |
|---|---|
| Name | Butyl 4-chlorobenzenepropanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.091707485 u |
| Formula | C13H17ClO2 |
| InChI | InChI=1S/C13H17ClO2/c1-2-3-10-16-13(15)9-6-11-4-7-12(14)8-5-11/h4-5,7-8H,2-3,6,9-10H2,1H3 |
| InChIKey | WPNNTKDTAKBZNO-UHFFFAOYSA-N |
| Molecular Weight | 240.730 g/mol |
| SMILES | C=1(C=CC(=CC1)Cl)CCC(=O)OCCCC |