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6-iodanyl-2-[(E)-2-phenylethenyl]chromen-4-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

6-iodanyl-2-[(E)-2-phenylethenyl]chromen-4-one
SpectraBase Compound ID 8aAexGhxyjB
InChI InChI=1S/C17H11IO2/c18-13-7-9-17-15(10-13)16(19)11-14(20-17)8-6-12-4-2-1-3-5-12/h1-11H/b8-6+
InChIKey YLVLTGOTUHMTQF-SOFGYWHQSA-N
Mol Weight 374.18 g/mol
Molecular Formula C17H11IO2
Exact Mass 373.980375 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 35UtmSW5LeN
Name 6-Iodanyl-2-[(E)-2-phenylethenyl]chromen-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.980374592 u
Formula C17H11IO2
InChI InChI=1S/C17H11IO2/c18-13-7-9-17-15(10-13)16(19)11-14(20-17)8-6-12-4-2-1-3-5-12/h1-11H/b8-6+
InChIKey YLVLTGOTUHMTQF-SOFGYWHQSA-N
Molecular Weight 374.177 g/mol
SMILES C1=2C(C=C(OC2C=CC(=C1)I)\C=C\C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926187