| SpectraBase Spectrum ID |
LFdS7QkAiiO |
| Name |
1-Hydroxy-3,3,5-trimethylcyclohexaneacetic acid, tert-butyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
256.203844759 u |
| Formula |
C15H28O3 |
| InChI |
InChI=1S/C15H28O3/c1-11-7-14(5,6)10-15(17,8-11)9-12(16)18-13(2,3)4/h11,17H,7-10H2,1-6H3 |
| InChIKey |
WIVAYTMSEUPIAP-UHFFFAOYSA-N |
| Molecular Weight |
256.386 g/mol |
| SMILES |
OC1(CC(CC(C1)(C)C)C)CC(=O)OC(C)(C)C |
| Spectrum/Structure Validation Score (Raman) |
0.816041 |
