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Succinic acid, 2-bromo-4-fluorophenyl 2-chloroethyl ester

View entire compound with spectra: 1 FTIR

Succinic acid, 2-bromo-4-fluorophenyl 2-chloroethyl ester
SpectraBase Compound ID GAcQNT8hEjU
InChI InChI=1S/C12H11BrClFO4/c13-9-7-8(15)1-2-10(9)19-12(17)4-3-11(16)18-6-5-14/h1-2,7H,3-6H2
InChIKey IFWQYAGKTGLKTB-UHFFFAOYSA-N
Mol Weight 353.57 g/mol
Molecular Formula C12H11BrClFO4
Exact Mass 351.951328 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A5GlWj4TNM9
Name Succinic acid, 2-bromo-4-fluorophenyl 2-chloroethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.951327693 u
Formula C12H11BrClFO4
InChI InChI=1S/C12H11BrClFO4/c13-9-7-8(15)1-2-10(9)19-12(17)4-3-11(16)18-6-5-14/h1-2,7H,3-6H2
InChIKey IFWQYAGKTGLKTB-UHFFFAOYSA-N
Molecular Weight 353.571 g/mol
SMILES C1=C(C(=CC(=C1)F)Br)OC(=O)CCC(OCCCl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952158