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Succinic acid, di(2-fluorophenethyl) ester
SpectraBase Compound ID K8H6FTpwR8I
InChI InChI=1S/C20H20F2O4/c21-17-7-3-1-5-15(17)11-13-25-19(23)9-10-20(24)26-14-12-16-6-2-4-8-18(16)22/h1-8H,9-14H2
InChIKey PYPYDOXKNRPBSB-UHFFFAOYSA-N
Mol Weight 362.37 g/mol
Molecular Formula C20H20F2O4
Exact Mass 362.132965 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CvnugK0yaBg
Name Succinic acid, di(2-fluorophenethyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.132965446 u
Formula C20H20F2O4
InChI InChI=1S/C20H20F2O4/c21-17-7-3-1-5-15(17)11-13-25-19(23)9-10-20(24)26-14-12-16-6-2-4-8-18(16)22/h1-8H,9-14H2
InChIKey PYPYDOXKNRPBSB-UHFFFAOYSA-N
Molecular Weight 362.373 g/mol
SMILES C(CCC(OCCC=1C=CC=CC1F)=O)(OCCC1=C(C=CC=C1)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.925768