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1,2-bis(2-Iodanyl-4,5-dimethoxy-phenyl)ethanone

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

1,2-bis(2-Iodanyl-4,5-dimethoxy-phenyl)ethanone
SpectraBase Compound ID Ja4kWMKu7JL
InChI InChI=1S/C18H18I2O5/c1-22-15-6-10(12(19)8-17(15)24-3)5-14(21)11-7-16(23-2)18(25-4)9-13(11)20/h6-9H,5H2,1-4H3
InChIKey IOZAKBXXQIFIEQ-UHFFFAOYSA-N
Mol Weight 568.15 g/mol
Molecular Formula C18H18I2O5
Exact Mass 567.924364 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9ce9OtRm5zx
Name 1,2-bis(2-Iodanyl-4,5-dimethoxy-phenyl)ethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 567.924363675 u
Formula C18H18I2O5
InChI InChI=1S/C18H18I2O5/c1-22-15-6-10(12(19)8-17(15)24-3)5-14(21)11-7-16(23-2)18(25-4)9-13(11)20/h6-9H,5H2,1-4H3
InChIKey IOZAKBXXQIFIEQ-UHFFFAOYSA-N
Molecular Weight 568.146 g/mol
SMILES C(CC=1C(=CC(=C(C1)OC)OC)I)(C=1C(=CC(=C(C1)OC)OC)I)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937219