For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-[Hydroxy(phenyl)methyl]-1-benzopyran-4-one
SpectraBase Compound ID FNFU3Ly3FBh
InChI InChI=1S/C16H12O3/c17-15(11-6-2-1-3-7-11)13-10-19-14-9-5-4-8-12(14)16(13)18/h1-10,15,17H
InChIKey OWQXJFPRJHARDA-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C16H12O3
Exact Mass 252.078644 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EGrvTlLrAB3
Name 3-[Hydroxy(phenyl)methyl]-1-benzopyran-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.078644243 u
Formula C16H12O3
InChI InChI=1S/C16H12O3/c17-15(11-6-2-1-3-7-11)13-10-19-14-9-5-4-8-12(14)16(13)18/h1-10,15,17H
InChIKey OWQXJFPRJHARDA-UHFFFAOYSA-N
Molecular Weight 252.269 g/mol
SMILES C=1(C(C=2C=CC=CC2OC1)=O)C(C1=CC=CC=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.94912