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1H-azepine, 1-[(4-bromo-2,5-dimethylphenyl)sulfonyl]hexahydro-
SpectraBase Compound ID C5MHa89XWeJ
InChI InChI=1S/C14H20BrNO2S/c1-11-10-14(12(2)9-13(11)15)19(17,18)16-7-5-3-4-6-8-16/h9-10H,3-8H2,1-2H3
InChIKey PWLCCNYRVLNZDB-UHFFFAOYSA-N
Mol Weight 346.28 g/mol
Molecular Formula C14H20BrNO2S
Exact Mass 345.039813 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FM2N9tsLgEo
Name 1H-azepine, 1-[(4-bromo-2,5-dimethylphenyl)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 345.039813060 u
Formula C14H20BrNO2S
InChI InChI=1S/C14H20BrNO2S/c1-11-10-14(12(2)9-13(11)15)19(17,18)16-7-5-3-4-6-8-16/h9-10H,3-8H2,1-2H3
InChIKey PWLCCNYRVLNZDB-UHFFFAOYSA-N
Molecular Weight 346.283 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12796
Solvent DMSO-d6
Source Vendor ID: ZI/10013769; Lab Info: DK; Lab Number: DK-1600511