SpectraBase Compound ID | DEVzKg3MJZA |
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InChI | InChI=1S/C8H17NO/c1-6-5-9(3)7(2)4-8(6)10/h6-8,10H,4-5H2,1-3H3 |
InChIKey | ZMPIXCGEZCZGGJ-UHFFFAOYSA-N |
Mol Weight | 143.23 g/mol |
Molecular Formula | C8H17NO |
Exact Mass | 143.131014 g/mol |
SpectraBase Spectrum ID | 9olspktQRoT |
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Name | 1,2,5-Trimethylpiperidin-4-ol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 143.131014170 u |
Formula | C8H17NO |
InChI | InChI=1S/C8H17NO/c1-6-5-9(3)7(2)4-8(6)10/h6-8,10H,4-5H2,1-3H3 |
InChIKey | ZMPIXCGEZCZGGJ-UHFFFAOYSA-N |
Molecular Weight | 143.230 g/mol |
SMILES | C1N(C(CC(C1C)O)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.840244 |