SpectraBase Compound ID | 271cRBYOeGv |
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InChI | InChI=1S/C21H44/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2/h5-20H2,1-4H3 |
InChIKey | HPNIGXOUZOTKHD-UHFFFAOYSA-N |
Mol Weight | 296.6 g/mol |
Molecular Formula | C21H44 |
Exact Mass | 296.344301 g/mol |
SpectraBase Spectrum ID | 9kDw0Kyd8t5 |
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Name | 3,3-Dimethylnonadecane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 296.344301417 u |
Formula | C21H44 |
InChI | InChI=1S/C21H44/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2/h5-20H2,1-4H3 |
InChIKey | HPNIGXOUZOTKHD-UHFFFAOYSA-N |
SMILES | CCCCCCCCCCCCCCCCC(CC)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916813 |