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Benzaldehyde, 2-fluoro-3,4-dibenzyloxy-5-hydroxy-
SpectraBase Compound ID DFGP56Hs5FW
InChI InChI=1S/C21H17FO4/c22-19-17(12-23)11-18(24)20(25-13-15-7-3-1-4-8-15)21(19)26-14-16-9-5-2-6-10-16/h1-12,24H,13-14H2
InChIKey YKPASGZYPZIHAQ-UHFFFAOYSA-N
Mol Weight 352.36 g/mol
Molecular Formula C21H17FO4
Exact Mass 352.111087 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7dK7TUb0HcS
Name Benzaldehyde, 2-fluoro-3,4-dibenzyloxy-5-hydroxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.111087186 u
Formula C21H17FO4
InChI InChI=1S/C21H17FO4/c22-19-17(12-23)11-18(24)20(25-13-15-7-3-1-4-8-15)21(19)26-14-16-9-5-2-6-10-16/h1-12,24H,13-14H2
InChIKey YKPASGZYPZIHAQ-UHFFFAOYSA-N
Molecular Weight 352.361 g/mol
SMILES C1=C(C(=C(C(=C1O)OCC1=CC=CC=C1)OCC1=CC=CC=C1)F)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.882837