SpectraBase Spectrum ID |
5mviekuorVl |
Name |
2-Methyl-3-[(1S,2S)-2-ethyl-1,3,3-trimethylcyclohexyl]tetrahydrofuran |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
238.229665585 u |
Formula |
C16H30O |
InChI |
InChI=1S/C16H30O/c1-6-14-15(3,4)9-7-10-16(14,5)13-8-11-17-12(13)2/h12-14H,6-11H2,1-5H3 |
InChIKey |
HOWCTRGAMYUIPB-UHFFFAOYSA-N |
Molecular Weight |
238.415 g/mol |
SMILES |
C1(CCOC1C)C1(CCCC(C1CC)(C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972116 |