SpectraBase Spectrum ID |
8JLhXLS6lAx |
Name |
2-Propen-1-ol, 2-methyl-3-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (E)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
194.167065327 u |
Formula |
C13H22O |
InChI |
InChI=1S/C13H22O/c1-10(9-14)8-12-11(2)6-5-7-13(12,3)4/h6,8,12,14H,5,7,9H2,1-4H3/b10-8+ |
InChIKey |
AUVMXAIUMYYTKT-CSKARUKUSA-N |
Molecular Weight |
194.318 g/mol |
SMILES |
CC1=CCCC(C1\C=C\(CO)C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982001 |