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1,4-bis[(3,4-dimethoxyphenyl)sulfonyl]hexahydro-1H-1,4-diazepine
SpectraBase Compound ID JXMyak3PNfe
InChI InChI=1S/C21H28N2O8S2/c1-28-18-8-6-16(14-20(18)30-3)32(24,25)22-10-5-11-23(13-12-22)33(26,27)17-7-9-19(29-2)21(15-17)31-4/h6-9,14-15H,5,10-13H2,1-4H3
InChIKey GJUFPAZNBPFNRI-UHFFFAOYSA-N
Mol Weight 500.58 g/mol
Molecular Formula C21H28N2O8S2
Exact Mass 500.128708 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KAmfT1gbOku
Name 1H-1,4-diazepine, 1,4-bis[(3,4-dimethoxyphenyl)sulfonyl]hexahydro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 500.128708210 u
Formula C21H28N2O8S2
InChI InChI=1S/C21H28N2O8S2/c1-28-18-8-6-16(14-20(18)30-3)32(24,25)22-10-5-11-23(13-12-22)33(26,27)17-7-9-19(29-2)21(15-17)31-4/h6-9,14-15H,5,10-13H2,1-4H3
InChIKey GJUFPAZNBPFNRI-UHFFFAOYSA-N
Molecular Weight 500.581 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12744
Solvent DMSO-d6
Source Vendor ID: ZI/10013852; Lab Info: DK; Lab Number: DK-1600256