SpectraBase Compound ID | 5W8TWwjzJ6a |
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InChI | InChI=1S/C6H11N.Cl/c1-7-5-3-2-4-6-7;/h2-3H,4-6H2,1H3; |
InChIKey | MTOVQENUPVHSMS-UHFFFAOYSA-N |
Mol Weight | 132.61 g/mol |
Molecular Formula | C6H11ClN |
Exact Mass | 132.058002 g/mol |
SpectraBase Spectrum ID | 2ugpjnKNPIZ |
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Name | 1-Methyl-1,2,3,6-tetrahydropyridine hydrochloride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 132.058002058 u |
Formula | C6H11ClN |
InChI | InChI=1S/C6H11N.Cl/c1-7-5-3-2-4-6-7;/h2-3H,4-6H2,1H3; |
InChIKey | MTOVQENUPVHSMS-UHFFFAOYSA-N |
Molecular Weight | 132.614 g/mol |
SMILES | [Cl].C1N(CCC=C1)C |
Spectrum/Structure Validation Score (Raman) | 0.943808 |