| SpectraBase Compound ID | 412Mch1CGyr |
|---|---|
| InChI | InChI=1S/C13H15ClO4/c1-3-17-12(15)10-6-4-5-7-11(10)13(16)18-8-9(2)14/h4-7,9H,3,8H2,1-2H3 |
| InChIKey | YFHRWQJTTKJKPE-UHFFFAOYSA-N |
| Mol Weight | 270.71 g/mol |
| Molecular Formula | C13H15ClO4 |
| Exact Mass | 270.065887 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 | xdSpirKqOx |
|---|---|
| Name | Phthalic acid, 2-chloropropyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.065886659 u |
| Formula | C13H15ClO4 |
| InChI | InChI=1S/C13H15ClO4/c1-3-17-12(15)10-6-4-5-7-11(10)13(16)18-8-9(2)14/h4-7,9H,3,8H2,1-2H3 |
| InChIKey | YFHRWQJTTKJKPE-UHFFFAOYSA-N |
| SMILES | C1=C(C(=CC=C1)C(=O)OCC(C)Cl)C(OCC)=O |