For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-({3-[(3,4-Dichlorophenyl)sulfonyl]phenyl}sulfonyl)azepane
SpectraBase Compound ID 8HygSd6BViK
InChI InChI=1S/C18H19Cl2NO4S2/c19-17-9-8-15(13-18(17)20)26(22,23)14-6-5-7-16(12-14)27(24,25)21-10-3-1-2-4-11-21/h5-9,12-13H,1-4,10-11H2
InChIKey OYDSDAWGCQHNSR-UHFFFAOYSA-N
Mol Weight 448.38 g/mol
Molecular Formula C18H19Cl2NO4S2
Exact Mass 447.013256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AqPlFrjQcv5
Name 1-({3-[(3,4-Dichlorophenyl)sulfonyl]phenyl}sulfonyl)azepane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19Cl2NO4S2
InChI InChI=1S/C18H19Cl2NO4S2/c19-17-9-8-15(13-18(17)20)26(22,23)14-6-5-7-16(12-14)27(24,25)21-10-3-1-2-4-11-21/h5-9,12-13H,1-4,10-11H2
InChIKey OYDSDAWGCQHNSR-UHFFFAOYSA-N
Molecular Weight 448.379 g/mol
SMILES C1CCN(S(c2cc(S(c3cc(Cl)c(cc3)Cl)(=O)=O)ccc2)(=O)=O)CCC1
SPLASH splash10-0005-9120100000-e398f666e0607a6afd50
Wiley ID 1451100