SpectraBase Spectrum ID |
7KZVA5MBKHx |
Name |
5-Bromo-2-(1-(4-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1-(methylsulfonyl)-1H-pyrrolo[2,3-b]pyridine |
Appearance |
Beige solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
464.966186551 u |
Formula |
C17H13BrClN5O2S |
InChI |
InChI=1S/C17H13BrClN5O2S/c1-27(25,26)24-16(7-12-6-13(18)8-20-17(12)24)15-10-23(22-21-15)9-11-2-4-14(19)5-3-11/h2-8,10H,9H2,1H3 |
InChIKey |
WCETUHZSMWUEKN-UHFFFAOYSA-N |
Instrument Name |
Finnigan TSQ 7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201801632 |
Molecular Weight |
466.741 g/mol |
Quality |
745 |
SMILES |
C1(=CC2=C(N=C1)N(C(=C2)C=1N=NN(C1)CC1=CC=C(C=C1)Cl)S(C)(=O)=O)Br |
SPLASH |
splash10-004i-4986100000-08caa8b854eb7d2c83b9 |
Source of Spectrum |
QE-24-SM10-1c (DOI: 10.1002/chem.201801632) |
Wiley ID |
1901571 |