| SpectraBase Spectrum ID |
B2MiWtnyUrH |
| Name |
4,8-di(4-Bromorophenyl)-3,7-dioxabicyclo[3.3.0]octane-2,6-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
449.910234862 u |
| Formula |
C18H12Br2O4 |
| InChI |
InChI=1S/C18H12Br2O4/c19-11-5-1-9(2-6-11)15-13-14(18(22)23-15)16(24-17(13)21)10-3-7-12(20)8-4-10/h1-8,13-16H |
| InChIKey |
IPIKEDVMVNRZAS-UHFFFAOYSA-N |
| Molecular Weight |
452.098 g/mol |
| SMILES |
C12C(C(=O)OC2C2=CC=C(C=C2)Br)C(C2=CC=C(C=C2)Br)OC1=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.86025 |
![4,8-Di(4-bromorophenyl)-3,7-dioxabicyclo[3.3.0]octane-2,6-dione](/api/spectrum/B2MiWtnyUrH/structure.png?h=300&w=458 "4,8-Di(4-bromorophenyl)-3,7-dioxabicyclo[3.3.0]octane-2,6-dione")
