| SpectraBase Spectrum ID |
AKZadHEaOdF |
| Name |
Cyclopentanone, 2,3-dimethyl-3-phenyl-, cis- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
188.120115134 u |
| Formula |
C13H16O |
| InChI |
InChI=1S/C13H16O/c1-10-12(14)8-9-13(10,2)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3/t10-,13+/m0/s1 |
| InChIKey |
XJGQIPNAUUJCNF-GXFFZTMASA-N |
| Molecular Weight |
188.270 g/mol |
| SMILES |
[C@]1([C@](C(=O)CC1)(C)[H])(C=1C=CC=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934654 |
