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4-Phenyl-3-(phenylmethyl)-2(5H)-furanone
SpectraBase Compound ID 2CjCTL6XKwi
InChI InChI=1S/C17H14O2/c18-17-15(11-13-7-3-1-4-8-13)16(12-19-17)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey KJGOARVXLMFYCA-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C17H14O2
Exact Mass 250.09938 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8XcTyPOi9Oo
Name 4-Phenyl-3-(phenylmethyl)-2(5H)-furanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.099379689 u
Formula C17H14O2
InChI InChI=1S/C17H14O2/c18-17-15(11-13-7-3-1-4-8-13)16(12-19-17)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey KJGOARVXLMFYCA-UHFFFAOYSA-N
Molecular Weight 250.297 g/mol
SMILES C1(OCC(=C1CC1=CC=CC=C1)C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.891665