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3-Benzyl-3-hydroxy-2-benzofuran-1-one
SpectraBase Compound ID 4LZbkm5ZSlO
InChI InChI=1S/C15H12O3/c16-14-12-8-4-5-9-13(12)15(17,18-14)10-11-6-2-1-3-7-11/h1-9,17H,10H2
InChIKey SNQJWBJIHWHILY-UHFFFAOYSA-N
Mol Weight 240.26 g/mol
Molecular Formula C15H12O3
Exact Mass 240.078644 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GAjg3wdRBXn
Name 3-Benzyl-3-hydroxy-2-benzofuran-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.078644243 u
Formula C15H12O3
InChI InChI=1S/C15H12O3/c16-14-12-8-4-5-9-13(12)15(17,18-14)10-11-6-2-1-3-7-11/h1-9,17H,10H2
InChIKey SNQJWBJIHWHILY-UHFFFAOYSA-N
Molecular Weight 240.258 g/mol
SMILES C1(OC(=O)C=2C1=CC=CC2)(CC1=CC=CC=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.812451