| SpectraBase Spectrum ID |
FCc2EaVRZOM |
| Name |
3,3-Dimethyl-1,1-diphenyl-2-butanone |
| 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/c1-18(2,3)17(19)16(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13,16H,1-3H3 |
| InChIKey |
HSIQEWKXIJALRF-UHFFFAOYSA-N |
| Molecular Weight |
252.357 g/mol |
| SMILES |
C=1C(=CC=CC1)C(C=1C=CC=CC1)C(=O)C(C)(C)C |
| Spectrum/Structure Validation Score (Raman) |
0.91727 |
