2-[(5-Bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
2-[(5-Bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol Structure
Systematic / IUPAC Name: 5-Bromo-4-chloro-1H-indol-3-yl hexopyranoside
ID: Reference4048
Other Names:
5-Bromo-4-chloro-3-indolyl α-D-mannopyranoside;
5-Bromo-4-chloro-3-indolyl-α-D-galactopyranoside;
5-Bromo-4-chloro-3-indolyl-α-D-glucopyranoside;
5-Bromo-4-chloro-3-indolyl-β-D-galactopyranoside ;
5-Bromo-4-chloro-3-indolyl-β-D-glucopyranoside
Formula: C14H15BrClNO6
Spectral Data
2-[(5-Bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 200 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 3/3/2016 10:54:29 AM |
Identificators
| InChI | InChI=1S/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2 |
| InChI Key | OPIFSICVWOWJMJ-UHFFFAOYSA-N |
| Canonical SMILES | C1=CC(=C(C2=C1NC=C2OC3C(C(C(C(O3)CO)O)O)O)Cl)Br |
| CAS | |
| Splash | |
| Other Names |
5-Bromo-4-chloro-3-indolyl α-D-mannopyranoside; 5-Bromo-4-chloro-3-indolyl-α-D-galactopyranoside; 5-Bromo-4-chloro-3-indolyl-α-D-glucopyranoside; 5-Bromo-4-chloro-3-indolyl-β-D-galactopyranoside ; 5-Bromo-4-chloro-3-indolyl-β-D-glucopyranoside ; 2-[(5-Bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol |