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

View entire compound with spectra: 1 NMR

2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)-N-(2,3-dimethylphenyl)acetamide
SpectraBase Compound ID 5ueMgwJpK7K
InChI InChI=1S/C20H18ClN5O3/c1-11-5-3-8-15(12(11)2)22-16(27)10-25-18-17(23-24-25)19(28)26(20(18)29)14-7-4-6-13(21)9-14/h3-9,17-18H,10H2,1-2H3,(H,22,27)
InChIKey UWJRNKAAFDPWGJ-UHFFFAOYSA-N
Mol Weight 411.85 g/mol
Molecular Formula C20H18ClN5O3
Exact Mass 411.109817 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DKNIe62dDK9
Name 2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)-N-(2,3-dimethylphenyl)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 411.109817157 u
Formula C20H18ClN5O3
InChI InChI=1S/C20H18ClN5O3/c1-11-5-3-8-15(12(11)2)22-16(27)10-25-18-17(23-24-25)19(28)26(20(18)29)14-7-4-6-13(21)9-14/h3-9,17-18H,10H2,1-2H3,(H,22,27)
InChIKey UWJRNKAAFDPWGJ-UHFFFAOYSA-N
Molecular Weight 411.849 g/mol
NMR Offset 17.9987
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9779
Solvent DMSO-d6
Source Vendor ID: NMR/13229822