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1-(4-Chloro-3-methoxy-benzenesulfonyl)-azepane

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1-(4-Chloro-3-methoxy-benzenesulfonyl)-azepane
SpectraBase Compound ID G8qFMab0oMm
InChI InChI=1S/C13H18ClNO3S/c1-18-13-10-11(6-7-12(13)14)19(16,17)15-8-4-2-3-5-9-15/h6-7,10H,2-5,8-9H2,1H3
InChIKey VFGFTDOTXGPWKW-UHFFFAOYSA-N
Mol Weight 303.8 g/mol
Molecular Formula C13H18ClNO3S
Exact Mass 303.069592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ETmaXUZDr86
Name 1H-azepine, 1-[(4-chloro-3-methoxyphenyl)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 303.069592315 u
Formula C13H18ClNO3S
InChI InChI=1S/C13H18ClNO3S/c1-18-13-10-11(6-7-12(13)14)19(16,17)15-8-4-2-3-5-9-15/h6-7,10H,2-5,8-9H2,1H3
InChIKey VFGFTDOTXGPWKW-UHFFFAOYSA-N
Molecular Weight 303.804 g/mol
NMR Offset 18.4673
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17008
Solvent DMSO-d6
Source Vendor ID: ZI/10053295; Lab Info: DK; Lab Number: DK-17221