| SpectraBase Spectrum ID |
3wTnMeZ3CX4 |
| Name |
3,7,11-Trimethyl-6,10-dodecadiene-1-carboxylic acid ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.224580204 u |
| Formula |
C17H30O2 |
| InChI |
InChI=1S/C17H30O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h9,11,16H,6-8,10,12-13H2,1-5H3/b15-11+ |
| InChIKey |
AVNMXCJYOADGLH-RVDMUPIBSA-N |
| Molecular Weight |
266.425 g/mol |
| SMILES |
C(CC(CC\C=C\(CCC=C(C)C)C)C)(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.986733 |
