SpectraBase Compound ID | T4MFX6XHPH |
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InChI | InChI=1S/C3H6I2O/c4-1-3(6)2-5/h3,6H,1-2H2 |
InChIKey | DNKPFCQEGBJJTE-UHFFFAOYSA-N |
Mol Weight | 311.89 g/mol |
Molecular Formula | C3H6I2O |
Exact Mass | 311.850805 g/mol |
SpectraBase Spectrum ID | 1R97oe3Awl9 |
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Name | 2-Propanol, 1,3-diiodo- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 311.850804812 u |
Formula | C3H6I2O |
InChI | InChI=1S/C3H6I2O/c4-1-3(6)2-5/h3,6H,1-2H2 |
InChIKey | DNKPFCQEGBJJTE-UHFFFAOYSA-N |
Molecular Weight | 311.889 g/mol |
SMILES | C(O)(CI)CI |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.831293 |