SpectraBase Spectrum ID |
JHwCb8nzGF9 |
Name |
(E)-8-Iodo-1-(2-tetrahydropyranyloxy)-6-octene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
338.074274979 u |
Formula |
C13H23IO2 |
InChI |
InChI=1S/C13H23IO2/c14-10-6-3-1-2-4-7-11-15-13-9-5-8-12-16-13/h6,10,13H,1-5,7-9,11-12H2/b10-6+ |
InChIKey |
VRCJWZGCQXYJCP-UXBLZVDNSA-N |
Molecular Weight |
338.229 g/mol |
SMILES |
C1(OCCCC1)OCCCCCC\C=C\I |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974398 |