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N-(4-bromophenyl)-2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide

View entire compound with spectra: 1 NMR

N-(4-bromophenyl)-2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide
SpectraBase Compound ID HUmzQFIDZ7P
InChI InChI=1S/C18H13BrClN5O3/c19-10-4-6-12(7-5-10)21-14(26)9-24-16-15(22-23-24)17(27)25(18(16)28)13-3-1-2-11(20)8-13/h1-8,15-16H,9H2,(H,21,26)
InChIKey BANGOKDXARERGX-UHFFFAOYSA-N
Mol Weight 462.69 g/mol
Molecular Formula C18H13BrClN5O3
Exact Mass 460.98903 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7RTzTAjxqH9
Name N-(4-bromophenyl)-2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.989029996 u
Formula C18H13BrClN5O3
InChI InChI=1S/C18H13BrClN5O3/c19-10-4-6-12(7-5-10)21-14(26)9-24-16-15(22-23-24)17(27)25(18(16)28)13-3-1-2-11(20)8-13/h1-8,15-16H,9H2,(H,21,26)
InChIKey BANGOKDXARERGX-UHFFFAOYSA-N
Molecular Weight 462.691 g/mol
NMR Offset 17.9979
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9768
Solvent DMSO-d6
Source Vendor ID: NMR/13229810