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1,3-Benzenediol, o-(3-phenylpropionyl)-
SpectraBase Compound ID 80oI3uDstN5
InChI InChI=1S/C15H14O3/c16-13-7-4-8-14(11-13)18-15(17)10-9-12-5-2-1-3-6-12/h1-8,11,16H,9-10H2
InChIKey FNUVUOZKISHUJB-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C15H14O3
Exact Mass 242.094294 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5kdvj2WOdl8
Name 1,3-Benzenediol, o-(3-phenylpropionyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.094294308 u
Formula C15H14O3
InChI InChI=1S/C15H14O3/c16-13-7-4-8-14(11-13)18-15(17)10-9-12-5-2-1-3-6-12/h1-8,11,16H,9-10H2
InChIKey FNUVUOZKISHUJB-UHFFFAOYSA-N
Molecular Weight 242.274 g/mol
SMILES C1=C(C=CC=C1O)OC(=O)CCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.867256