SpectraBase Compound ID | 7pCiC6mKvOZ |
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InChI | InChI=1S/C14H29N/c1-4-6-8-13-10-12(3)11-14(15-13)9-7-5-2/h12-15H,4-11H2,1-3H3 |
InChIKey | ORTHSLQUCMXTCU-UHFFFAOYSA-N |
Mol Weight | 211.39 g/mol |
Molecular Formula | C14H29N |
Exact Mass | 211.23 g/mol |
SpectraBase Spectrum ID | Dxl3deYqPeN |
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Name | (2S,6R)-2,6-Dibutyl-4-methylpiperidine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 211.229999938 u |
Formula | C14H29N |
InChI | InChI=1S/C14H29N/c1-4-6-8-13-10-12(3)11-14(15-13)9-7-5-2/h12-15H,4-11H2,1-3H3 |
InChIKey | ORTHSLQUCMXTCU-UHFFFAOYSA-N |
Molecular Weight | 211.393 g/mol |
SMILES | C1C(NC(CC1C)CCCC)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937248 |