SpectraBase Compound ID | 7Dup1T6I3jA |
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InChI | InChI=1S/C15H29N/c1-3-5-6-8-14-11-10-13(4-2)15-9-7-12-16(14)15/h13-15H,3-12H2,1-2H3 |
InChIKey | JKTKWCMICJIACV-UHFFFAOYSA-N |
Mol Weight | 223.4 g/mol |
Molecular Formula | C15H29N |
Exact Mass | 223.23 g/mol |
SpectraBase Spectrum ID | 6IbXeloiR4z |
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Name | 8-Pentyl-5-ethylindolizidine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 223.229999938 u |
Formula | C15H29N |
InChI | InChI=1S/C15H29N/c1-3-5-6-8-14-11-10-13(4-2)15-9-7-12-16(14)15/h13-15H,3-12H2,1-2H3 |
InChIKey | JKTKWCMICJIACV-UHFFFAOYSA-N |
Molecular Weight | 223.404 g/mol |
SMILES | C12N(C(CCC2CC)CCCCC)CCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.945928 |