SpectraBase Compound ID | 5GRkHyuYRyC |
---|---|
InChI | InChI=1S/C11H21NO/c1-3-4-5-11(13)12-8-6-10(2)7-9-12/h10H,3-9H2,1-2H3 |
InChIKey | WYZKREZWXXWGCS-UHFFFAOYSA-N |
Mol Weight | 183.29 g/mol |
Molecular Formula | C11H21NO |
Exact Mass | 183.162314 g/mol |
SpectraBase Spectrum ID | IBPlthca0o9 |
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Name | N-Valeroyl-4-methylpiperidine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 183.162314299 u |
Formula | C11H21NO |
InChI | InChI=1S/C11H21NO/c1-3-4-5-11(13)12-8-6-10(2)7-9-12/h10H,3-9H2,1-2H3 |
InChIKey | WYZKREZWXXWGCS-UHFFFAOYSA-N |
Molecular Weight | 183.295 g/mol |
SMILES | C(N1CCC(CC1)C)(CCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952223 |