| SpectraBase Spectrum ID |
KzNM2gI4Dbx |
| Name |
2,4,8,10-Tetrabromo-6,12-epoxy-6H,12H-dibenzo[B,F][1,5]dioxocin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
537.705046050 u |
| Formula |
C14H6Br4O3 |
| InChI |
InChI=1S/C14H6Br4O3/c15-5-1-7-11(9(17)3-5)19-14-8-2-6(16)4-10(18)12(8)20-13(7)21-14/h1-4,13-14H/t13-,14-/m1/s1 |
| InChIKey |
OIMWFZGSWAXTPN-ZIAGYGMSSA-N |
| Molecular Weight |
541.815 g/mol |
| SMILES |
[C@@]12(C=3C(=C(Br)C=C(C3)Br)O[C@](O1)(C=1C(O2)=C(C=C(Br)C1)Br)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951515 |
![2,4,8,10-Tetrabromo-6,12-epoxy-6H,12H-dibenzo[b,f][1,5]dioxocin](/api/spectrum/KzNM2gI4Dbx/structure.png?h=300&w=458 "2,4,8,10-Tetrabromo-6,12-epoxy-6H,12H-dibenzo[b,f][1,5]dioxocin")
