SpectraBase Compound ID | 7zlKctxQVqm |
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InChI | InChI=1S/C20H42/c1-8-18(6)13-15-20(14-12-17(4)5)19(7)11-9-10-16(2)3/h16-20H,8-15H2,1-7H3 |
InChIKey | LSVDXMJHSYNAGC-UHFFFAOYSA-N |
Mol Weight | 282.6 g/mol |
Molecular Formula | C20H42 |
Exact Mass | 282.328651 g/mol |
SpectraBase Spectrum ID | 6JfjHWqWGir |
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Name | 7-(3-Methylbutyl)-2,6,10-trimethyldodecane |
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/c1-8-18(6)13-15-20(14-12-17(4)5)19(7)11-9-10-16(2)3/h16-20H,8-15H2,1-7H3 |
InChIKey | LSVDXMJHSYNAGC-UHFFFAOYSA-N |
SMILES | CC(C)CCCC(C)C(CCC(C)C)CCC(C)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.922367 |