| SpectraBase Spectrum ID |
7tYGwt5yHxe |
| Name |
Tricyclo[4.2.1.0(2,5)]non-7-en-3-one, 4-(phenylmethylene)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.104465070 u |
| Formula |
C16H14O |
| InChI |
InChI=1S/C16H14O/c17-16-13(8-10-4-2-1-3-5-10)14-11-6-7-12(9-11)15(14)16/h1-8,11-12,14-15H,9H2/b13-8- |
| InChIKey |
GOAKAHXJDDHMIF-JYRVWZFOSA-N |
| Molecular Weight |
222.287 g/mol |
| SMILES |
C1(=O)C2C3CC(C2\C1=C/C1=CC=CC=C1)C=C3 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828595 |
![Tricyclo[4.2.1.0(2,5)]non-7-en-3-one, 4-(phenylmethylene)-](/api/spectrum/7tYGwt5yHxe/structure.png?h=300&w=458 "Tricyclo[4.2.1.0(2,5)]non-7-en-3-one, 4-(phenylmethylene)-")
