SpectraBase Spectrum ID |
LYjNZ2IswUa |
Name |
Ethyl-(E,E,E)-[1-(14)C]-dehydrofarnesate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
262.193280075 u |
Formula |
C17H26O2 |
InChI |
InChI=1S/C17H26O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h8-9,11-13H,6-7,10H2,1-5H3/b12-8+,15-11+,16-13+ |
InChIKey |
IXLSHKVMEQBNOO-LLKPRGDRSA-N |
Molecular Weight |
262.393 g/mol |
SMILES |
C(=O)(\C=C\(\C=C\C=C\(CCC=C(C)C)C)C)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903406 |