| SpectraBase Spectrum ID |
IiAuqGIuPdP |
| Name |
(5E)-2,2-Dimethyl-6-phenyl-5-hexen-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
202.135765199 u |
| Formula |
C14H18O |
| InChI |
InChI=1S/C14H18O/c1-14(2,3)13(15)11-7-10-12-8-5-4-6-9-12/h4-10H,11H2,1-3H3/b10-7+ |
| InChIKey |
LEAJXRODHPKUDG-JXMROGBWSA-N |
| Molecular Weight |
202.297 g/mol |
| SMILES |
C(C(C)(C)C)(=O)C\C=C\C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933246 |
