SpectraBase Spectrum ID |
2ayiLxB1NEy |
Name |
(E)-Tert-butyl 3-(2-(2,2-dibromovinyl)phenyl)acrylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
385.951705753 u |
Formula |
C15H16Br2O2 |
InChI |
InChI=1S/C15H16Br2O2/c1-15(2,3)19-14(18)9-8-11-6-4-5-7-12(11)10-13(16)17/h4-10H,1-3H3/b9-8+ |
InChIKey |
CQCWCEITRFNZAE-CMDGGOBGSA-N |
Molecular Weight |
388.099 g/mol |
SMILES |
C=1C=C(C(=CC1)\C=C\C(OC(C)(C)C)=O)C=C(Br)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.800608 |