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Succinic acid, 3-methylbut-2-en-1-yl 2,2,2-trichloroethyl ester

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Succinic acid, 3-methylbut-2-en-1-yl 2,2,2-trichloroethyl ester
SpectraBase Compound ID 75y8SZ17YVN
InChI InChI=1S/C11H15Cl3O4/c1-8(2)5-6-17-9(15)3-4-10(16)18-7-11(12,13)14/h5H,3-4,6-7H2,1-2H3
InChIKey QQCFQPGWUQZUAG-UHFFFAOYSA-N
Mol Weight 317.6 g/mol
Molecular Formula C11H15Cl3O4
Exact Mass 316.003592 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BP55EmiRe4F
Name Succinic acid, 3-methylbut-2-en-1-yl 2,2,2-trichloroethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.003592059 u
Formula C11H15Cl3O4
InChI InChI=1S/C11H15Cl3O4/c1-8(2)5-6-17-9(15)3-4-10(16)18-7-11(12,13)14/h5H,3-4,6-7H2,1-2H3
InChIKey QQCFQPGWUQZUAG-UHFFFAOYSA-N
Molecular Weight 317.596 g/mol
SMILES C(CC(OCC=C(C)C)=O)C(OCC(Cl)(Cl)Cl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.935355