SpectraBase Spectrum ID |
IBUMHnVcx67 |
Name |
(1R*,2S*)-1-Ethenyl-2-(1'(S*)-hydroxyethyl)cyclopentanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
156.115029753 u |
Formula |
C9H16O2 |
InChI |
InChI=1S/C9H16O2/c1-3-9(11)6-4-5-8(9)7(2)10/h3,7-8,10-11H,1,4-6H2,2H3/t7-,8-,9-/m0/s1 |
InChIKey |
HMYSKKHAFDIDSV-CIUDSAMLSA-N |
Molecular Weight |
156.225 g/mol |
SMILES |
[C@]1([C@]([C@@](O)(C)[H])(CCC1)[H])(C=C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912636 |