SpectraBase Compound ID | G63YSOrWjBQ |
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InChI | InChI=1S/C10H11Cl3O4/c1-3-7(2)17-9(15)5-4-8(14)16-6-10(11,12)13/h1,7H,4-6H2,2H3 |
InChIKey | JORUEHRSAZFKGR-UHFFFAOYSA-N |
Mol Weight | 301.55 g/mol |
Molecular Formula | C10H11Cl3O4 |
Exact Mass | 299.972292 g/mol |
SpectraBase Spectrum ID | CZ25W0WgNkv |
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Name | Succinic acid, but-3-yn-2-yl 2,2,2-trichloroethyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 299.972291930 u |
Formula | C10H11Cl3O4 |
InChI | InChI=1S/C10H11Cl3O4/c1-3-7(2)17-9(15)5-4-8(14)16-6-10(11,12)13/h1,7H,4-6H2,2H3 |
InChIKey | JORUEHRSAZFKGR-UHFFFAOYSA-N |
Molecular Weight | 301.553 g/mol |
SMILES | C(CC(OC(C#C)C)=O)C(OCC(Cl)(Cl)Cl)=O |