| SpectraBase Spectrum ID |
7U7eBRMqgdq |
| Name |
4-(T-Butyl)-1-methylcyclohexyl p-(hydroxycarbonyl)phenyl ketone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
302.188194694 u |
| Formula |
C19H26O3 |
| InChI |
InChI=1S/C19H26O3/c1-18(2,3)15-9-11-19(4,12-10-15)16(20)13-5-7-14(8-6-13)17(21)22/h5-8,15H,9-12H2,1-4H3,(H,21,22) |
| InChIKey |
JOBNKZMORMWCOZ-UHFFFAOYSA-N |
| SMILES |
C(C1(CCC(C(C)(C)C)CC1)C)(C1=CC=C(C(=O)O)C=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936675 |
