| SpectraBase Spectrum ID |
8Asi1Yudf4A |
| Name |
4-(T-Butyl)-1-methylcyclohexyl p-cyanophenyl ketone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
283.193614428 u |
| Formula |
C19H25NO |
| InChI |
InChI=1S/C19H25NO/c1-18(2,3)16-9-11-19(4,12-10-16)17(21)15-7-5-14(13-20)6-8-15/h5-8,16H,9-12H2,1-4H3 |
| InChIKey |
UMEAHUWXJGJMBU-UHFFFAOYSA-N |
| Molecular Weight |
283.415 g/mol |
| SMILES |
C(C1(CCC(C(C)(C)C)CC1)C)(C1=CC=C(C#N)C=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907595 |
