| SpectraBase Compound ID | 2GVQ1O4w6ti |
|---|---|
| InChI | InChI=1S/C15H15Cl3O5/c16-9-6-11(17)15(12(18)7-9)23-14(20)4-3-13(19)22-8-10-2-1-5-21-10/h6-7,10H,1-5,8H2 |
| InChIKey | JKDJEJNKXLVEQV-UHFFFAOYSA-N |
| Mol Weight | 381.64 g/mol |
| Molecular Formula | C15H15Cl3O5 |
| Exact Mass | 379.998507 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LJOkBlNglsp |
|---|---|
| Name | Succinic acid, 2,4,6-trichlorophenyl tetrahydrofurfuryl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 379.998506678 u |
| Formula | C15H15Cl3O5 |
| InChI | InChI=1S/C15H15Cl3O5/c16-9-6-11(17)15(12(18)7-9)23-14(20)4-3-13(19)22-8-10-2-1-5-21-10/h6-7,10H,1-5,8H2 |
| InChIKey | JKDJEJNKXLVEQV-UHFFFAOYSA-N |
| Molecular Weight | 381.639 g/mol |
| SMILES | C(CC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OCC1OCCC1)=O |