SpectraBase Compound ID | I0yMzO2MtHx |
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InChI | InChI=1S/C8H16Cl2/c9-7-5-3-1-2-4-6-8-10/h1-8H2 |
InChIKey | WXYMNDFVLNUAIA-UHFFFAOYSA-N |
Mol Weight | 183.12 g/mol |
Molecular Formula | C8H16Cl2 |
Exact Mass | 182.062906 g/mol |
SpectraBase Spectrum ID | GCDPmQucSnu |
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Name | 1,8-Dichlorooctane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 182.062905915 u |
Formula | C8H16Cl2 |
InChI | InChI=1S/C8H16Cl2/c9-7-5-3-1-2-4-6-8-10/h1-8H2 |
InChIKey | WXYMNDFVLNUAIA-UHFFFAOYSA-N |
Molecular Weight | 183.122 g/mol |
SMILES | C(Cl)CCCCCCCCl |
Spectrum/Structure Validation Score (Raman) | 0.987665 |