SpectraBase Spectrum ID |
4rz1X68lxSh |
Name |
Bicyclo[8.2.2]tetradeca-10,12,14-triene, 5,6-dibromo-, cis- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
343.977526580 u |
Formula |
C14H18Br2 |
InChI |
InChI=1S/C14H18Br2/c15-13-5-1-3-11-7-9-12(10-8-11)4-2-6-14(13)16/h7-10,13-14H,1-6H2/t13-,14+ |
InChIKey |
UUFACYAFUGDHQC-OKILXGFUSA-N |
Molecular Weight |
346.106 g/mol |
SMILES |
[C@@]1([C@](Br)(CCCC2=CC=C(CCC1)C=C2)[H])(Br)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945466 |