| SpectraBase Spectrum ID |
LkkbmTFkBKm |
| Name |
4-(T-Butyl)-1-methylcyclohexyl p-methylphenyl ketone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.214015521 u |
| Formula |
C19H28O |
| InChI |
InChI=1S/C19H28O/c1-14-6-8-15(9-7-14)17(20)19(5)12-10-16(11-13-19)18(2,3)4/h6-9,16H,10-13H2,1-5H3 |
| InChIKey |
XQPXZXGDAWGTGY-UHFFFAOYSA-N |
| Molecular Weight |
272.432 g/mol |
| SMILES |
C(C1(CCC(C(C)(C)C)CC1)C)(C1=CC=C(C=C1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948757 |
