| SpectraBase Spectrum ID |
GXQ6FDxfX6j |
| Name |
[(E)-2-((1R,3S)-2,2-Dibromo-3-tert-butyl-cyclopropyl)-vinyl]-benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.977526580 u |
| Formula |
C15H18Br2 |
| InChI |
InChI=1S/C15H18Br2/c1-14(2,3)13-12(15(13,16)17)10-9-11-7-5-4-6-8-11/h4-10,12-13H,1-3H3/b10-9+/t12-,13+/m1/s1 |
| InChIKey |
ZLJVRQQNGZWLNT-GBYBRZQVSA-N |
| Molecular Weight |
358.117 g/mol |
| SMILES |
C1([C@](\C=C\C=2C=CC=CC2)([C@]1(C(C)(C)C)[H])[H])(Br)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879887 |
![[(E)-2-((1R,3S)-2,2-Dibromo-3-tert-butyl-cyclopropyl)-vinyl]-benzene](/api/spectrum/GXQ6FDxfX6j/structure.png?h=300&w=458 "[(E)-2-((1R,3S)-2,2-Dibromo-3-tert-butyl-cyclopropyl)-vinyl]-benzene")
