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Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4-dichlorophenyl ester

View entire compound with spectra: 1 FTIR

Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4-dichlorophenyl ester
SpectraBase Compound ID 9bfEcspTeE7
InChI InChI=1S/C13H11Cl2F3O4/c1-7(13(16,17)18)21-11(19)4-5-12(20)22-10-3-2-8(14)6-9(10)15/h2-3,6-7H,4-5H2,1H3
InChIKey SCZFJFWHPNNENY-UHFFFAOYSA-N
Mol Weight 359.13 g/mol
Molecular Formula C13H11Cl2F3O4
Exact Mass 357.998649 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LOOaMtvi66f
Name Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4-dichlorophenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 357.998648719 u
Formula C13H11Cl2F3O4
InChI InChI=1S/C13H11Cl2F3O4/c1-7(13(16,17)18)21-11(19)4-5-12(20)22-10-3-2-8(14)6-9(10)15/h2-3,6-7H,4-5H2,1H3
InChIKey SCZFJFWHPNNENY-UHFFFAOYSA-N
Molecular Weight 359.128 g/mol
SMILES C(CC(OC(C)C(F)(F)F)=O)C(OC=1C=CC(=CC1Cl)Cl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.893724