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benzenepropanamine, N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-alpha-methyl-
SpectraBase Compound ID DxWFEMy6Wac
InChI InChI=1S/C26H29ClN4O4S/c1-20(7-8-21-5-3-2-4-6-21)28-25-19-23(11-14-26(25)31(32)33)29-15-17-30(18-16-29)36(34,35)24-12-9-22(27)10-13-24/h2-6,9-14,19-20,28H,7-8,15-18H2,1H3
InChIKey WGQYOEKOSSUXDG-UHFFFAOYSA-N
Mol Weight 529.06 g/mol
Molecular Formula C26H29ClN4O4S
Exact Mass 528.159804 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dx9tYj7M99K
Name benzenepropanamine, N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-alpha-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 528.159804300 u
Formula C26H29ClN4O4S
InChI InChI=1S/C26H29ClN4O4S/c1-20(7-8-21-5-3-2-4-6-21)28-25-19-23(11-14-26(25)31(32)33)29-15-17-30(18-16-29)36(34,35)24-12-9-22(27)10-13-24/h2-6,9-14,19-20,28H,7-8,15-18H2,1H3
InChIKey WGQYOEKOSSUXDG-UHFFFAOYSA-N
Molecular Weight 529.055 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7097
Solvent DMSO-d6
Source Vendor ID: NMR/10220698; Lab Info: LP; Lab Number: LP-2501194
Temperature 29.85 °C