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

*Links on SpectraBase are not permalinks.

8-chloro-1-[(p-chlorophenyl)sulfonyl]-2,3-dihydro-5-hydroxy-1H-1-benzazepine-4-carbonitrile, p-chlorobenzenesulfonate (ester)

View entire compound with spectra: 2 NMR, and 1 FTIR

8-chloro-1-[(p-chlorophenyl)sulfonyl]-2,3-dihydro-5-hydroxy-1H-1-benzazepine-4-carbonitrile, p-chlorobenzenesulfonate (ester)
SpectraBase Compound ID AZdGjX7VRWh
InChI InChI=1S/C23H15Cl3N2O5S2/c24-16-1-6-19(7-2-16)34(29,30)28-12-11-15(14-27)23(21-10-5-18(26)13-22(21)28)33-35(31,32)20-8-3-17(25)4-9-20/h1-10,13H,11-12H2
InChIKey RJSXTKVIFUTBDD-UHFFFAOYSA-N
Mol Weight 569.86 g/mol
Molecular Formula C23H15Cl3N2O5S2
Exact Mass 567.948797 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 4BD5AoJPOz
Name 8-CHLORO-1-[(p-CHLOROPHENYL)SULFONYL]-2,3-DIHYDRO-5-HYDROXY-1H-1-BENZAZEPINE-4-CARBONITRILE, p-CHLOROBENZENESULFONATE (ESTER)
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H15Cl3N2O5S2
InChI InChI=1S/C23H15Cl3N2O5S2/c24-16-1-6-19(7-2-16)34(29,30)28-12-11-15(14-27)23(21-10-5-18(26)13-22(21)28)33-35(31,32)20-8-3-17(25)4-9-20/h1-10,13H,11-12H2
InChIKey RJSXTKVIFUTBDD-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 569.87
Solvent DMSO-d6; Reference=TMS; Temperature 297K