| SpectraBase Spectrum ID |
AXEjY9y70U4 |
| Name |
2-Hexanone, 4,5,5-trimethyl-1,1,1-triphenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.229665585 u |
| Formula |
C27H30O |
| InChI |
InChI=1S/C27H30O/c1-21(26(2,3)4)20-25(28)27(22-14-8-5-9-15-22,23-16-10-6-11-17-23)24-18-12-7-13-19-24/h5-19,21H,20H2,1-4H3 |
| InChIKey |
RPEGIRBRHGRDRN-UHFFFAOYSA-N |
| Molecular Weight |
370.536 g/mol |
| SMILES |
C1=CC=C(C=C1)C(C(=O)CC(C)C(C)(C)C)(C=1C=CC=CC1)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870576 |
