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N-(4-acetylphenyl)-2-(5-(4-methylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide
SpectraBase Compound ID 5aJzFaGRX1r
InChI InChI=1S/C21H19N5O4/c1-12-3-9-16(10-4-12)26-20(29)18-19(21(26)30)25(24-23-18)11-17(28)22-15-7-5-14(6-8-15)13(2)27/h3-10,18-19H,11H2,1-2H3,(H,22,28)
InChIKey UOQDDJOQEXQNPV-UHFFFAOYSA-N
Mol Weight 405.41 g/mol
Molecular Formula C21H19N5O4
Exact Mass 405.143704 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8zLbbed39Ra
Name N-(4-acetylphenyl)-2-(5-(4-methylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)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/C21H19N5O4/c1-12-3-9-16(10-4-12)26-20(29)18-19(21(26)30)25(24-23-18)11-17(28)22-15-7-5-14(6-8-15)13(2)27/h3-10,18-19H,11H2,1-2H3,(H,22,28)
InChIKey UOQDDJOQEXQNPV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9053
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: UZI/1263131; Labnumber: Gbb0308; UZI_ID: UZI-009055
Temperature 318 °C