SpectraBase Spectrum ID |
5jBUNUmFWdG |
Name |
(R)-3-[2-(4-Methylphenyl)vinyl]cyclohexanone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
214.135765199 u |
Formula |
C15H18O |
InChI |
InChI=1S/C15H18O/c1-12-5-7-13(8-6-12)9-10-14-3-2-4-15(16)11-14/h5-10,14H,2-4,11H2,1H3/b10-9+/t14-/m0/s1 |
InChIKey |
SICJIEPOUFXUDK-HBWSCVEGSA-N |
Molecular Weight |
214.308 g/mol |
SMILES |
[C@]1(\C=C\C=2C=CC(=CC2)C)(CC(=O)CCC1)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918714 |