SpectraBase Compound ID | DNs5TwL0YH6 |
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InChI | InChI=1S/C20H42/c1-5-9-11-12-13-14-15-17-19-20(7-3,8-4)18-16-10-6-2/h5-19H2,1-4H3 |
InChIKey | DBQGQSCHJJUMOP-UHFFFAOYSA-N |
Mol Weight | 282.6 g/mol |
Molecular Formula | C20H42 |
Exact Mass | 282.328651 g/mol |
SpectraBase Spectrum ID | gIcwSPapjw |
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Name | 6,6-Diethylhexadecane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 282.328651352 u |
Formula | C20H42 |
InChI | InChI=1S/C20H42/c1-5-9-11-12-13-14-15-17-19-20(7-3,8-4)18-16-10-6-2/h5-19H2,1-4H3 |
InChIKey | DBQGQSCHJJUMOP-UHFFFAOYSA-N |
SMILES | CCCCCC(CCCCCCCCCC)(CC)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952878 |