SpectraBase Spectrum ID |
6K1JhGSdTMo |
Name |
(2R*,9Z)-2-Bromo-9-(bromomethylidene)-1,1-dimethyl-5-methylene-spiro[5.5]undec-7-ene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
357.993176644 u |
Formula |
C15H20Br2 |
InChI |
InChI=1S/C15H20Br2/c1-11-4-5-13(17)14(2,3)15(11)8-6-12(10-16)7-9-15/h6,8,10,13H,1,4-5,7,9H2,2-3H3/b12-10+/t13-,15?/m1/s1 |
InChIKey |
TZEMMCWTQQXORZ-FELBXNJMSA-N |
Molecular Weight |
360.133 g/mol |
SMILES |
C12(C([C@](Br)(CCC2=C)[H])(C)C)C=C\C(CC1)=C/Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.853428 |