SpectraBase Spectrum ID |
IN85yV3qHq8 |
Name |
(1S,2R)-2-[(Z)-hex-1-Enyl]-1-cyclopentanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
168.151415263 u |
Formula |
C11H20O |
InChI |
InChI=1S/C11H20O/c1-2-3-4-5-7-10-8-6-9-11(10)12/h5,7,10-12H,2-4,6,8-9H2,1H3/b7-5-/t10-,11-/m0/s1 |
InChIKey |
URJCBEFTXBDCBI-MGVUPCTHSA-N |
Molecular Weight |
168.280 g/mol |
SMILES |
[C@@]1(\C=C/CCCC)([C@@](O)(CCC1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955427 |