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4-oxazolecarbonitrile, 2-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-5-(4-methyl-1-piperazinyl)-
SpectraBase Compound ID 1QTmmUKyPvH
InChI InChI=1S/C21H27N5O4S/c1-24-10-12-25(13-11-24)21-17(15-22)23-20(30-21)16-6-7-18(29-2)19(14-16)31(27,28)26-8-4-3-5-9-26/h6-7,14H,3-5,8-13H2,1-2H3
InChIKey MSBKKXAYZNUGMG-UHFFFAOYSA-N
Mol Weight 445.54 g/mol
Molecular Formula C21H27N5O4S
Exact Mass 445.178376 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5AsOKqMwFpq
Name 4-oxazolecarbonitrile, 2-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-5-(4-methyl-1-piperazinyl)-
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/C21H27N5O4S/c1-24-10-12-25(13-11-24)21-17(15-22)23-20(30-21)16-6-7-18(29-2)19(14-16)31(27,28)26-8-4-3-5-9-26/h6-7,14H,3-5,8-13H2,1-2H3
InChIKey MSBKKXAYZNUGMG-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10445
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: F37766; Labnumber: TVIN-03940
Temperature 315 °C