SpectraBase Spectrum ID |
6fwmo1DvmVI |
Name |
(E)-2-[5,5-Bis(phenylsulfonyl)pent-2-en-1-yl]-1-(pyridin-2-yl)-1H-indole |
Appearance |
Colorless solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
542.133399669 u |
Formula |
C30H26N2O4S2 |
InChI |
InChI=1S/C30H26N2O4S2/c33-37(34,26-15-3-1-4-16-26)30(38(35,36)27-17-5-2-6-18-27)21-10-8-14-25-23-24-13-7-9-19-28(24)32(25)29-20-11-12-22-31-29/h1-13,15-20,22-23,30H,14,21H2/b10-8+ |
InChIKey |
ALHLSKCEJORVJK-CSKARUKUSA-N |
Instrument Name |
Finnigan MAT 95 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201701191 |
Molecular Weight |
542.668 g/mol |
Quality |
173 |
Reported Formula |
C30H26N2O4S2 |
SMILES |
C(S(C1=CC=CC=C1)(=O)=O)(C\C=C\CC=1N(C2=C(C1)C=CC=C2)C1=NC=CC=C1)S(C1=CC=CC=C1)(=O)=O |
SPLASH |
splash10-066s-2090000000-66191003954f0f9e2894 |
Sample Comments |
E/Z = 8:1 |
Source of Spectrum |
QE-23-SM21-(E)-3ac (DOI: 10.1002/chem.201701191) |
Wiley ID |
1905446 |