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acetamide, 2-[[3-(4-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]thio]-N-[(tetrahydro-2-furanyl)methyl]-
SpectraBase Compound ID 66kXDWz3PO5
InChI InChI=1S/C22H20N6O4S/c29-19(23-12-16-4-3-11-32-16)13-33-22-24-18-6-2-1-5-17(18)21-26-25-20(27(21)22)14-7-9-15(10-8-14)28(30)31/h1-2,5-10,16H,3-4,11-13H2,(H,23,29)
InChIKey YZNDCBNAOVSIAJ-UHFFFAOYSA-N
Mol Weight 464.5 g/mol
Molecular Formula C22H20N6O4S
Exact Mass 464.126674 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CFDfpUssbs0
Name acetamide, 2-[[3-(4-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]thio]-N-[(tetrahydro-2-furanyl)methyl]-
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/C22H20N6O4S/c29-19(23-12-16-4-3-11-32-16)13-33-22-24-18-6-2-1-5-17(18)21-26-25-20(27(21)22)14-7-9-15(10-8-14)28(30)31/h1-2,5-10,16H,3-4,11-13H2,(H,23,29)
InChIKey YZNDCBNAOVSIAJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6239
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: NMR/11308573