SpectraBase Compound ID | 1AUPOLglvhv |
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InChI | InChI=1S/C8H8I2O2/c1-11-7-3-6(10)8(12-2)4-5(7)9/h3-4H,1-2H3 |
InChIKey | GLVOXVCTGAISRY-UHFFFAOYSA-N |
Mol Weight | 389.96 g/mol |
Molecular Formula | C8H8I2O2 |
Exact Mass | 389.861369 g/mol |
SpectraBase Spectrum ID | CjeKlwLstzW |
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Name | 2,5-Dimethoxy-1,4-diiodobenzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 389.861369496 u |
Formula | C8H8I2O2 |
InChI | InChI=1S/C8H8I2O2/c1-11-7-3-6(10)8(12-2)4-5(7)9/h3-4H,1-2H3 |
InChIKey | GLVOXVCTGAISRY-UHFFFAOYSA-N |
Molecular Weight | 389.959 g/mol |
SMILES | C=1(OC)C(=CC(=C(I)C1)OC)I |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939484 |