| SpectraBase Spectrum ID |
HqxYfD0aWdD |
| Name |
Methanone, [4-[2-[3,5-bis(1,1-dimethylethyl)phenyl]ethenyl]phenyl]ph enyl-, (E)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.245315649 u |
| Formula |
C29H32O |
| InChI |
InChI=1S/C29H32O/c1-28(2,3)24-18-23(19-25(20-24)29(4,5)6)26(17-21-13-9-7-10-14-21)27(30)22-15-11-8-12-16-22/h7-20H,1-6H3/b26-17+ |
| InChIKey |
RUQHOALFVOGICC-YZSQISJMSA-N |
| Molecular Weight |
396.574 g/mol |
| SMILES |
C=1(\C(C(=O)C2=CC=CC=C2)=C/C=2C=CC=CC2)C=C(C(C)(C)C)C=C(C1)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896715 |
![Methanone, [4-[2-[3,5-bis(1,1-dimethylethyl)phenyl]ethenyl]phenyl]ph enyl-, (E)-](/api/spectrum/HqxYfD0aWdD/structure.png?h=300&w=458 "Methanone, [4-[2-[3,5-bis(1,1-dimethylethyl)phenyl]ethenyl]phenyl]ph enyl-, (E)-")
