| SpectraBase Compound ID | 4Y5tMKO4bzh |
|---|---|
| InChI | InChI=1S/C15H15Cl3O4/c1-9(2)5-6-21-13(19)3-4-14(20)22-15-11(17)7-10(16)8-12(15)18/h5,7-8H,3-4,6H2,1-2H3 |
| InChIKey | XHRSLDXMLPPRBE-UHFFFAOYSA-N |
| Mol Weight | 365.64 g/mol |
| Molecular Formula | C15H15Cl3O4 |
| Exact Mass | 364.003592 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68R0pnChR6g |
|---|---|
| Name | Succinic acid, 3-methylbut-2-en-1-yl 2,4,6-trichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 364.003592059 u |
| Formula | C15H15Cl3O4 |
| InChI | InChI=1S/C15H15Cl3O4/c1-9(2)5-6-21-13(19)3-4-14(20)22-15-11(17)7-10(16)8-12(15)18/h5,7-8H,3-4,6H2,1-2H3 |
| InChIKey | XHRSLDXMLPPRBE-UHFFFAOYSA-N |
| Molecular Weight | 365.640 g/mol |
| SMILES | C(CC(OCC=C(C)C)=O)C(OC1=C(C=C(C=C1Cl)Cl)Cl)=O |