| SpectraBase Spectrum ID |
3natwaAIoBU |
| Name |
Hexabromobenzene |
| Source of Sample |
Sigma-Aldrich Cat. #45524 |
| CAS Registry Number |
87-82-1 |
| Classification |
Pesticides |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
545.510028000 u |
| Formula |
C6Br6 |
| InChI |
InChI=1S/C6Br6/c7-1-2(8)4(10)6(12)5(11)3(1)9 |
| InChIKey |
CAYGQBVSOZLICD-UHFFFAOYSA-N |
| Molecular Weight |
551.490 g/mol |
| Number of Peaks |
49 |
| RI1 |
2450 |
| SMILES |
c1(c(c(Br)c(c(c1Br)Br)Br)Br)Br |
| SPLASH |
splash10-006t-2865890000-82fabe6a9263941f15c1 |
| Sample Comments |
RI1: measured on SLB-5ms (Alkanes)
RI2: measured on Equity-1 (Alkanes) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Benzene, 1,2,3,4,5,6-hexabromo- |
| Wiley ID |
LM_PEST_818 |
