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2,1-benzisoxazole-5-carboxamide, N-[2-oxo-2-[[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]amino]ethyl]-3-phenyl-
SpectraBase Compound ID 1QQSTPW5caw
InChI InChI=1S/C25H19N5O4/c31-21(26-15-22-28-24(30-33-22)17-9-5-2-6-10-17)14-27-25(32)18-11-12-20-19(13-18)23(34-29-20)16-7-3-1-4-8-16/h1-13H,14-15H2,(H,26,31)(H,27,32)
InChIKey MCOXPQPTJRXHSA-UHFFFAOYSA-N
Mol Weight 453.46 g/mol
Molecular Formula C25H19N5O4
Exact Mass 453.143704 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 92VBbBkMwOQ
Name 2,1-benzisoxazole-5-carboxamide, N-[2-oxo-2-[[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]amino]ethyl]-3-phenyl-
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/C25H19N5O4/c31-21(26-15-22-28-24(30-33-22)17-9-5-2-6-10-17)14-27-25(32)18-11-12-20-19(13-18)23(34-29-20)16-7-3-1-4-8-16/h1-13H,14-15H2,(H,26,31)(H,27,32)
InChIKey MCOXPQPTJRXHSA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3836
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: F18587; Labnumber: ExLab-198075