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N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-cyanophenyl)sulfanyl]benzamide

View entire compound with spectra: 2 NMR

N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-cyanophenyl)sulfanyl]benzamide
SpectraBase Compound ID EQNNzoMOpaS
InChI InChI=1S/C22H16N2O3S/c23-12-16-5-1-3-7-20(16)28-21-8-4-2-6-17(21)22(25)24-13-15-9-10-18-19(11-15)27-14-26-18/h1-11H,13-14H2,(H,24,25)
InChIKey HJRIGSNQNHOTML-UHFFFAOYSA-N
Mol Weight 388.44 g/mol
Molecular Formula C22H16N2O3S
Exact Mass 388.088164 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D5HAjLp6F5y
Name N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-cyanophenyl)sulfanyl]benzamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H16N2O3S/c23-12-16-5-1-3-7-20(16)28-21-8-4-2-6-17(21)22(25)24-13-15-9-10-18-19(11-15)27-14-26-18/h1-11H,13-14H2,(H,24,25)
InChIKey HJRIGSNQNHOTML-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3086
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D08975; Labnumber: SPPOL-2681; SBI_ID: SBI-003088
Temperature 315 °C