| SpectraBase Spectrum ID |
LL833QTZDFE |
| Name |
(E)-3,7-Dimethylocta-2,6-dienyl ethyl carbonate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.156894565 u |
| Formula |
C13H22O3 |
| InChI |
InChI=1S/C13H22O3/c1-5-15-13(14)16-10-9-12(4)8-6-7-11(2)3/h7,9H,5-6,8,10H2,1-4H3/b12-9+ |
| InChIKey |
VHCQYGMNMOULRZ-FMIVXFBMSA-N |
| Molecular Weight |
226.316 g/mol |
| SMILES |
C(=O)(OCC)OC\C=C\(CCC=C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951578 |
