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Succinic acid, di(4-bromophenethyl) ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Succinic acid, di(4-bromophenethyl) ester
SpectraBase Compound ID 7OSk055X9MP
InChI InChI=1S/C20H20Br2O4/c21-17-5-1-15(2-6-17)11-13-25-19(23)9-10-20(24)26-14-12-16-3-7-18(22)8-4-16/h1-8H,9-14H2
InChIKey QKUJBWNZIHKZTD-UHFFFAOYSA-N
Mol Weight 484.18 g/mol
Molecular Formula C20H20Br2O4
Exact Mass 481.972835 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2LTY4HjHrFc
Name Succinic acid, di(4-bromophenethyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.972835120 u
Formula C20H20Br2O4
InChI InChI=1S/C20H20Br2O4/c21-17-5-1-15(2-6-17)11-13-25-19(23)9-10-20(24)26-14-12-16-3-7-18(22)8-4-16/h1-8H,9-14H2
InChIKey QKUJBWNZIHKZTD-UHFFFAOYSA-N
Molecular Weight 484.184 g/mol
SMILES C(CCC(OCCC1=CC=C(C=C1)Br)=O)(OCCC1=CC=C(C=C1)Br)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.89061