SpectraBase Compound ID | 5IYSolHTA21 |
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InChI | InChI=1S/C17H36N2/c1-6-8-10-15(3)18-12-13-19(17(5)14-18)16(4)11-9-7-2/h15-17H,6-14H2,1-5H3 |
InChIKey | WZRGCTLPVDKUNT-UHFFFAOYSA-N |
Mol Weight | 268.5 g/mol |
Molecular Formula | C17H36N2 |
Exact Mass | 268.287849 g/mol |
SpectraBase Spectrum ID | 4FuP75cgzvR |
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Name | 1,4-di(hex-2-yl)-2-Methylpiperazine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 268.287849167 u |
Formula | C17H36N2 |
InChI | InChI=1S/C17H36N2/c1-6-8-10-15(3)18-12-13-19(17(5)14-18)16(4)11-9-7-2/h15-17H,6-14H2,1-5H3 |
InChIKey | WZRGCTLPVDKUNT-UHFFFAOYSA-N |
SMILES | C1(N(CCN(C1)C(CCCC)C)C(CCCC)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.956445 |