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[1,1'-biphenyl]-4-carboxamide, N-[4-[(hexahydro-1H-azepin-1-yl)sulfonyl]phenyl]-
SpectraBase Compound ID 9DRD8ukwXIG
InChI InChI=1S/C25H26N2O3S/c28-25(22-12-10-21(11-13-22)20-8-4-3-5-9-20)26-23-14-16-24(17-15-23)31(29,30)27-18-6-1-2-7-19-27/h3-5,8-17H,1-2,6-7,18-19H2,(H,26,28)
InChIKey IXHLUMUDVPSYSE-UHFFFAOYSA-N
Mol Weight 434.55 g/mol
Molecular Formula C25H26N2O3S
Exact Mass 434.166414 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4OSSg9t7D5D
Name [1,1'-biphenyl]-4-carboxamide, N-[4-[(hexahydro-1H-azepin-1-yl)sulfonyl]phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.166413876 u
Formula C25H26N2O3S
InChI InChI=1S/C25H26N2O3S/c28-25(22-12-10-21(11-13-22)20-8-4-3-5-9-20)26-23-14-16-24(17-15-23)31(29,30)27-18-6-1-2-7-19-27/h3-5,8-17H,1-2,6-7,18-19H2,(H,26,28)
InChIKey IXHLUMUDVPSYSE-UHFFFAOYSA-N
Molecular Weight 434.554 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15702
Solvent DMSO-d6
Source Vendor ID: ZI/10067476; Lab Info: MUS; Lab Number: 5172