SpectraBase Compound ID | 6FIAGU8KrGG |
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InChI | InChI=1S/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3 |
InChIKey | UZOFELREXGAFOI-UHFFFAOYSA-N |
Mol Weight | 99.18 g/mol |
Molecular Formula | C6H13N |
Exact Mass | 99.104799 g/mol |
SpectraBase Spectrum ID | AH6SwQa5TkL |
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Name | 4-Pipecoline |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 99.104799423 u |
Formula | C6H13N |
InChI | InChI=1S/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3 |
InChIKey | UZOFELREXGAFOI-UHFFFAOYSA-N |
Molecular Weight | 99.177 g/mol |
SMILES | C1C(C)CCNC1 |
Spectrum/Structure Validation Score (Raman) | 0.959942 |