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1-{3-[(5-bromo-2-thienyl)sulfonyl]propanoyl}-4-(5-chloro-2-methylphenyl)piperazine
SpectraBase Compound ID CvDgyaOTU6F
InChI InChI=1S/C18H20BrClN2O3S2/c1-13-2-3-14(20)12-15(13)21-7-9-22(10-8-21)17(23)6-11-27(24,25)18-5-4-16(19)26-18/h2-5,12H,6-11H2,1H3
InChIKey AZQNZVWLYXEBCK-UHFFFAOYSA-N
Mol Weight 491.85 g/mol
Molecular Formula C18H20BrClN2O3S2
Exact Mass 489.978726 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AXvNulUcAi7
Name 1-{3-[(5-bromo-2-thienyl)sulfonyl]propanoyl}-4-(5-chloro-2-methylphenyl)piperazine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 489.978725557 u
Formula C18H20BrClN2O3S2
InChI InChI=1S/C18H20BrClN2O3S2/c1-13-2-3-14(20)12-15(13)21-7-9-22(10-8-21)17(23)6-11-27(24,25)18-5-4-16(19)26-18/h2-5,12H,6-11H2,1H3
InChIKey AZQNZVWLYXEBCK-UHFFFAOYSA-N
Molecular Weight 491.846 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1159
Solvent DMSO-d6
Source Vendor ID: NMR/12269265