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4-Bromo-5-[bis[2-hydroxy-3-fluoropropyl]]aminoveratrole

View entire compound with spectra: 1 FTIR

4-Bromo-5-[bis[2-hydroxy-3-fluoropropyl]]aminoveratrole
SpectraBase Compound ID KI19HZexsKL
InChI InChI=1S/C14H20BrF2NO4/c1-21-13-3-11(15)12(4-14(13)22-2)18(7-9(19)5-16)8-10(20)6-17/h3-4,9-10,19-20H,5-8H2,1-2H3
InChIKey FLRYOHRVIXNVQK-UHFFFAOYSA-N
Mol Weight 384.22 g/mol
Molecular Formula C14H20BrF2NO4
Exact Mass 383.054377 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HHJxIeiq7CB
Name 4-Bromo-5-[bis[2-hydroxy-3-fluoropropyl]]aminoveratrole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 383.054377450 u
Formula C14H20BrF2NO4
InChI InChI=1S/C14H20BrF2NO4/c1-21-13-3-11(15)12(4-14(13)22-2)18(7-9(19)5-16)8-10(20)6-17/h3-4,9-10,19-20H,5-8H2,1-2H3
InChIKey FLRYOHRVIXNVQK-UHFFFAOYSA-N
Molecular Weight 384.218 g/mol
SMILES C1(=CC(N(CC(CF)O)CC(O)CF)=C(C=C1OC)Br)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956373