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1H-azepine, 1-[(4-chloro-3-nitrophenyl)sulfonyl]hexahydro-
SpectraBase Compound ID BVKF5rpX9ZG
InChI InChI=1S/C12H15ClN2O4S/c13-11-6-5-10(9-12(11)15(16)17)20(18,19)14-7-3-1-2-4-8-14/h5-6,9H,1-4,7-8H2
InChIKey CRHJSGALSIKJLW-UHFFFAOYSA-N
Mol Weight 318.78 g/mol
Molecular Formula C12H15ClN2O4S
Exact Mass 318.044106 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 26rfAGqI1nl
Name 1H-azepine, 1-[(4-chloro-3-nitrophenyl)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 318.044105841 u
Formula C12H15ClN2O4S
InChI InChI=1S/C12H15ClN2O4S/c13-11-6-5-10(9-12(11)15(16)17)20(18,19)14-7-3-1-2-4-8-14/h5-6,9H,1-4,7-8H2
InChIKey CRHJSGALSIKJLW-UHFFFAOYSA-N
Molecular Weight 318.775 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3421
Solvent DMSO-d6
Source Vendor ID: NMR/9278245; Lab Number: BAS 0668099
Temperature 29.85 °C