SpectraBase Compound ID | OEu6btuZcv |
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InChI | InChI=1S/C9H17NO2/c1-3-12-9(11)8-4-6-10(2)7-5-8/h8H,3-7H2,1-2H3 |
InChIKey | JWXOOQCMGJBSML-UHFFFAOYSA-N |
Mol Weight | 171.24 g/mol |
Molecular Formula | C9H17NO2 |
Exact Mass | 171.125929 g/mol |
SpectraBase Spectrum ID | 6fad0NCFgNr |
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Name | Ethyl-1-methylpiperidine-4-carboxylate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 171.125928789 u |
Formula | C9H17NO2 |
InChI | InChI=1S/C9H17NO2/c1-3-12-9(11)8-4-6-10(2)7-5-8/h8H,3-7H2,1-2H3 |
InChIKey | JWXOOQCMGJBSML-UHFFFAOYSA-N |
Molecular Weight | 171.240 g/mol |
SMILES | CN1CCC(CC1)C(=O)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959841 |