SpectraBase Compound ID | L4EzlxuoJKK |
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InChI | InChI=1S/C9H19NO/c1-2-9(11)7-8-5-3-4-6-10-8/h8-11H,2-7H2,1H3/t8?,9-/m0/s1 |
InChIKey | ZRXAUOSECWYDMA-GKAPJAKFSA-N |
Mol Weight | 157.26 g/mol |
Molecular Formula | C9H19NO |
Exact Mass | 157.146664 g/mol |
SpectraBase Spectrum ID | 5KzvHjaeGj0 |
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Name | (2' S)-2-(2'-Hydroxybutyl)piperidine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 157.146664235 u |
Formula | C9H19NO |
InChI | InChI=1S/C9H19NO/c1-2-9(11)7-8-5-3-4-6-10-8/h8-11H,2-7H2,1H3/t8?,9-/m0/s1 |
InChIKey | ZRXAUOSECWYDMA-GKAPJAKFSA-N |
Molecular Weight | 157.257 g/mol |
SMILES | C1(NCCCC1)C[C@@](O)(CC)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967364 |