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pyrrolo[3,4-d][1,2,3]triazole-1-acetamide, N-(3-chloro-4-methoxyphenyl)-5-(3-chlorophenyl)-1,3a,4,5,6,6a-hexahydro-4,6-dioxo-

View entire compound with spectra: 1 NMR

pyrrolo[3,4-d][1,2,3]triazole-1-acetamide, N-(3-chloro-4-methoxyphenyl)-5-(3-chlorophenyl)-1,3a,4,5,6,6a-hexahydro-4,6-dioxo-
SpectraBase Compound ID I5PFWJEVoud
InChI InChI=1S/C19H15Cl2N5O4/c1-30-14-6-5-11(8-13(14)21)22-15(27)9-25-17-16(23-24-25)18(28)26(19(17)29)12-4-2-3-10(20)7-12/h2-8,16-17H,9H2,1H3,(H,22,27)
InChIKey JCWLZOLUOVHOFN-UHFFFAOYSA-N
Mol Weight 448.27 g/mol
Molecular Formula C19H15Cl2N5O4
Exact Mass 447.050109 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IgLAQ8mLTSi
Name pyrrolo[3,4-d][1,2,3]triazole-1-acetamide, N-(3-chloro-4-methoxyphenyl)-5-(3-chlorophenyl)-1,3a,4,5,6,6a-hexahydro-4,6-dioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.050109379 u
Formula C19H15Cl2N5O4
InChI InChI=1S/C19H15Cl2N5O4/c1-30-14-6-5-11(8-13(14)21)22-15(27)9-25-17-16(23-24-25)18(28)26(19(17)29)12-4-2-3-10(20)7-12/h2-8,16-17H,9H2,1H3,(H,22,27)
InChIKey JCWLZOLUOVHOFN-UHFFFAOYSA-N
Molecular Weight 448.266 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_61
Solvent DMSO-d6
Source Vendor ID: NMR/13238413