| SpectraBase Spectrum ID |
LexKFAoFpNE |
| Name |
4-(T-Butyl)-1-methylcyclohexyl p-fluorophenyl ketone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
276.188943587 u |
| Formula |
C18H25FO |
| InChI |
InChI=1S/C18H25FO/c1-17(2,3)14-9-11-18(4,12-10-14)16(20)13-5-7-15(19)8-6-13/h5-8,14H,9-12H2,1-4H3 |
| InChIKey |
OKEHLUFMYVVPSX-UHFFFAOYSA-N |
| Molecular Weight |
276.395 g/mol |
| SMILES |
C(C1(CCC(C(C)(C)C)CC1)C)(C1=CC=C(C=C1)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937361 |
