| SpectraBase Spectrum ID |
K2ZLWiZlpwB |
| Name |
Benzenemethanol, .alpha.-(1,2-dimethyl-2-butenyl)-, [R*,S*-(E)]-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
190.135765199 u |
| Formula |
C13H18O |
| InChI |
InChI=1S/C13H18O/c1-4-10(2)11(3)13(14)12-8-6-5-7-9-12/h4-9,11,13-14H,1-3H3/b10-4- |
| InChIKey |
GFURWWSAHSOTNA-WMZJFQQLSA-N |
| Molecular Weight |
190.286 g/mol |
| SMILES |
C(C(C=1C=CC=CC1)O)(\C(=C/C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.875601 |
![Benzenemethanol, .alpha.-(1,2-dimethyl-2-butenyl)-, [R*,S*-(E)]-(.+-.)-](/api/spectrum/K2ZLWiZlpwB/structure.png?h=300&w=458 "Benzenemethanol, .alpha.-(1,2-dimethyl-2-butenyl)-, [R*,S*-(E)]-(.+-.)-")
