| SpectraBase Compound ID | 2lYA5IpZaEV |
|---|---|
| InChI | InChI=1S/C17H15ClO4/c1-11(2)21-16(19)14-5-3-4-6-15(14)17(20)22-13-9-7-12(18)8-10-13/h3-11H,1-2H3 |
| InChIKey | UMBDOBWHZPQYCH-UHFFFAOYSA-N |
| Mol Weight | 318.76 g/mol |
| Molecular Formula | C17H15ClO4 |
| Exact Mass | 318.065887 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6lWcCNU3usx |
|---|---|
| Name | Phthalic acid, 4-chlorophenyl 2-propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.065886659 u |
| Formula | C17H15ClO4 |
| InChI | InChI=1S/C17H15ClO4/c1-11(2)21-16(19)14-5-3-4-6-15(14)17(20)22-13-9-7-12(18)8-10-13/h3-11H,1-2H3 |
| InChIKey | UMBDOBWHZPQYCH-UHFFFAOYSA-N |
| Molecular Weight | 318.756 g/mol |
| SMILES | C1(=C(C=CC=C1)C(OC(C)C)=O)C(OC1=CC=C(C=C1)Cl)=O |