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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-(2,4-dimethoxyphenyl)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-(2,4-dimethoxyphenyl)acetamide
SpectraBase Compound ID ColBFN0fZcO
InChI InChI=1S/C20H18ClN5O5/c1-30-13-6-7-14(15(9-13)31-2)22-16(27)10-25-18-17(23-24-25)19(28)26(20(18)29)12-5-3-4-11(21)8-12/h3-9,17-18H,10H2,1-2H3,(H,22,27)
InChIKey DWWRNJUUMBJLQP-UHFFFAOYSA-N
Mol Weight 443.85 g/mol
Molecular Formula C20H18ClN5O5
Exact Mass 443.099646 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FRi6j2urcya
Name 2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)-N-(2,4-dimethoxyphenyl)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 443.099646395 u
Formula C20H18ClN5O5
InChI InChI=1S/C20H18ClN5O5/c1-30-13-6-7-14(15(9-13)31-2)22-16(27)10-25-18-17(23-24-25)19(28)26(20(18)29)12-5-3-4-11(21)8-12/h3-9,17-18H,10H2,1-2H3,(H,22,27)
InChIKey DWWRNJUUMBJLQP-UHFFFAOYSA-N
Molecular Weight 443.847 g/mol
NMR Offset 17.9983
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9778
Solvent DMSO-d6
Source Vendor ID: NMR/13229820