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4-Benzyloxy-3-fluorobenzeneboronic acid
SpectraBase Compound ID 3ytm4KbFHsa
InChI InChI=1S/C13H12BFO3/c15-12-8-11(14(16)17)6-7-13(12)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2
InChIKey DQPDLDQJMUGVGI-UHFFFAOYSA-N
Mol Weight 246.0 g/mol
Molecular Formula C13H12BFO3
Exact Mass 246.086353 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 2XTuhY6c9lu
Name 4-Benzyloxy-3-fluorobenzeneboronic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.086352576 u
Formula C13H12BFO3
InChI InChI=1S/C13H12BFO3/c15-12-8-11(14(16)17)6-7-13(12)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2
InChIKey DQPDLDQJMUGVGI-UHFFFAOYSA-N
Molecular Weight 246.044 g/mol
SMILES OB(C=1C=C(C(=CC1)OCC=1C=CC=CC1)F)O
Spectrum/Structure Validation Score (Raman) 0.907978