SpectraBase Spectrum ID |
FHxOy1B4AhJ |
Name |
(R)-1-((S)-6-Pentyl-2,3,4,5-tetrahydro-pyridin-2-yl)-propan-2-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
211.193614428 u |
Formula |
C13H25NO |
InChI |
InChI=1S/C13H25NO/c1-3-4-5-7-12-8-6-9-13(14-12)10-11(2)15/h11,13,15H,3-10H2,1-2H3/t11-,13+/m1/s1 |
InChIKey |
AXYTZGJVBWIBMN-YPMHNXCESA-N |
Molecular Weight |
211.349 g/mol |
SMILES |
[C@]1(N=C(CCC1)CCCCC)(C[C@](O)(C)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867123 |