SpectraBase Spectrum ID |
IVAAy3Bg0pZ |
Name |
2,6-Dimethyl-3-acetoxy-8-[2'-(tetrahydropyranyl)oxy]octa-1,6(E)-diene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
296.198759378 u |
Formula |
C17H28O4 |
InChI |
InChI=1S/C17H28O4/c1-13(2)16(21-15(4)18)9-8-14(3)10-12-20-17-7-5-6-11-19-17/h10,16-17H,1,5-9,11-12H2,2-4H3/b14-10+ |
InChIKey |
DJZITZLJWJRLAM-GXDHUFHOSA-N |
Molecular Weight |
296.407 g/mol |
SMILES |
C(OC(C(=C)C)CC\C(=C\COC1OCCCC1)C)(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911948 |