| SpectraBase Spectrum ID |
4GI8eqWCu0 |
| Name |
(+)-3-(2,3-Dibromo-4,5-dihydroxyphenyl)-4-bromo-5,6-dihydroxy-1,3-dihydroisobenzofuran |
| Appearance |
Brown powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H9Br3O5 |
| InChI |
InChI=1S/C14H9Br3O5/c15-9-5(2-7(19)13(21)11(9)17)14-8-4(3-22-14)1-6(18)12(20)10(8)16/h1-2,14,18-21H,3H2 |
| InChIKey |
VPLSCECMILOJAG-UHFFFAOYSA-N |
| Instrument Name |
Micromass Autospec-Ultima ETOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np0400609 |
| Molecular Weight |
496.933 g/mol |
| Optical Rotation |
[a]D20 = +6 (c = 0.16, MeOH) |
| Reported Formula |
C14H9(79)Br3O5 |
| SMILES |
Oc1c(cc(C2c3c(c(c(cc3CO2)O)O)Br)c(c1Br)Br)O |
| SPLASH |
splash10-0032-0090200000-cea3752ceae677da2c51 |
| Source of Spectrum |
G4-67-1665-5 |
| Wiley ID |
1881547 |
