| SpectraBase Spectrum ID |
99XQ5CEiaA8 |
| Name |
,alpha.-(7-Methylidenebicyclo[3.3.1]non-2-en-1-yl)acetophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.151415263 u |
| Formula |
C18H20O |
| InChI |
InChI=1S/C18H20O/c1-13-7-14-9-15(8-13)11-16(10-14)12-18(19)17-5-3-2-4-6-17/h2-6,10,14-15H,1,7-9,11-12H2 |
| InChIKey |
DDPUBNQILZKPDF-UHFFFAOYSA-N |
| Molecular Weight |
252.357 g/mol |
| SMILES |
C1(=CC2CC(CC(C1)C2)=C)CC(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973084 |
![,alpha.-(7-Methylidenebicyclo[3.3.1]non-2-en-1-yl)acetophenone](/api/spectrum/99XQ5CEiaA8/structure.png?h=300&w=458 ",alpha.-(7-Methylidenebicyclo[3.3.1]non-2-en-1-yl)acetophenone")
