| SpectraBase Spectrum ID |
4PpKfeRiKXQ |
| Name |
2,6-Ditert-butyl-4-(2,2,4,4-tetramethyl-3-oxidanylidene-cyclobutylidene)cyclohexa-2,5-dien-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.240230268 u |
| Formula |
C22H32O2 |
| InChI |
InChI=1S/C22H32O2/c1-19(2,3)14-11-13(12-15(16(14)23)20(4,5)6)17-21(7,8)18(24)22(17,9)10/h11-12H,1-10H3 |
| InChIKey |
IEBJCWZPVNYFFN-UHFFFAOYSA-N |
| Molecular Weight |
328.496 g/mol |
| SMILES |
C1(=C2C=C(C(C)(C)C)C(C(=C2)C(C)(C)C)=O)C(C)(C)C(C1(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949198 |
