SpectraBase Spectrum ID |
9J5Vlpfpq9V |
Name |
3-(hex-1'-Enyl)cyclopropane-2,2-dimethylcyclopropane-1-methanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
182.167065327 u |
Formula |
C12H22O |
InChI |
InChI=1S/C12H22O/c1-4-5-6-7-8-10-11(9-13)12(10,2)3/h7-8,10-11,13H,4-6,9H2,1-3H3/b8-7+ |
InChIKey |
IVSHPYGSJGFETO-BQYQJAHWSA-N |
Molecular Weight |
182.307 g/mol |
SMILES |
C1(C(\C=C\CCCC)C1CO)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966557 |