SpectraBase Spectrum ID |
4IHF9mp6YPj |
Name |
4-Isopropylidene-5-methylene-2-(2-iodophenyl)-1-hexene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
338.053145612 u |
Formula |
C16H19I |
InChI |
InChI=1S/C16H19I/c1-11(2)15(12(3)4)10-13(5)14-8-6-7-9-16(14)17/h6-9H,1,5,10H2,2-4H3 |
InChIKey |
YJYLJSXFTXGKGZ-UHFFFAOYSA-N |
Molecular Weight |
338.232 g/mol |
SMILES |
C1(=C(C=CC=C1)C(CC(C(C)=C)=C(C)C)=C)I |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.841719 |