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2-(3-methylphenoxy)-N-{4-[4-(methylsulfonyl)-1-piperazinyl]phenyl}acetamide
SpectraBase Compound ID JHhQ67lVWxy
InChI InChI=1S/C20H25N3O4S/c1-16-4-3-5-19(14-16)27-15-20(24)21-17-6-8-18(9-7-17)22-10-12-23(13-11-22)28(2,25)26/h3-9,14H,10-13,15H2,1-2H3,(H,21,24)
InChIKey GQMSBWCCGBBRIS-UHFFFAOYSA-N
Mol Weight 403.5 g/mol
Molecular Formula C20H25N3O4S
Exact Mass 403.156577 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 55RSSiBdvor
Name 2-(3-methylphenoxy)-N-{4-[4-(methylsulfonyl)-1-piperazinyl]phenyl}acetamide
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/C20H25N3O4S/c1-16-4-3-5-19(14-16)27-15-20(24)21-17-6-8-18(9-7-17)22-10-12-23(13-11-22)28(2,25)26/h3-9,14H,10-13,15H2,1-2H3,(H,21,24)
InChIKey GQMSBWCCGBBRIS-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5005
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: E12745; Labnumber: SPMOS1-47446; SBI_ID: SBI-005007
Temperature 308 °C