SpectraBase Spectrum ID |
3CJrnL8X0b3 |
Name |
(5E)-2,2-Dimethyl-5-(2-methylpropylidene)-1-cyclopentanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
168.151415263 u |
Formula |
C11H20O |
InChI |
InChI=1S/C11H20O/c1-8(2)7-9-5-6-11(3,4)10(9)12/h7-8,10,12H,5-6H2,1-4H3/b9-7+ |
InChIKey |
ONTXVIMKXTXXOC-VQHVLOKHSA-N |
Molecular Weight |
168.280 g/mol |
SMILES |
C1(\C(CCC1(C)C)=C\C(C)C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939948 |