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

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Succinic acid, 3-methylbut-2-en-1-yl 3-fluorophenyl ester
SpectraBase Compound ID 5AEmE7dls6c
InChI InChI=1S/C15H17FO4/c1-11(2)8-9-19-14(17)6-7-15(18)20-13-5-3-4-12(16)10-13/h3-5,8,10H,6-7,9H2,1-2H3
InChIKey RDDYQCHVKDENAB-UHFFFAOYSA-N
Mol Weight 280.3 g/mol
Molecular Formula C15H17FO4
Exact Mass 280.111087 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JnofFhPNDkJ
Name Succinic acid, 3-methylbut-2-en-1-yl 3-fluorophenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.111087186 u
Formula C15H17FO4
InChI InChI=1S/C15H17FO4/c1-11(2)8-9-19-14(17)6-7-15(18)20-13-5-3-4-12(16)10-13/h3-5,8,10H,6-7,9H2,1-2H3
InChIKey RDDYQCHVKDENAB-UHFFFAOYSA-N
Molecular Weight 280.295 g/mol
SMILES C(CC(OCC=C(C)C)=O)C(OC1=CC=CC(=C1)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.874036