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diethyl 1-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
SpectraBase Compound ID I054FkvavOa
InChI InChI=1S/C17H19BrN4O5/c1-4-26-16(24)14-15(17(25)27-5-2)22(21-20-14)9-13(23)19-11-6-7-12(18)10(3)8-11/h6-8H,4-5,9H2,1-3H3,(H,19,23)
InChIKey QPHDMOUGAKTPJI-UHFFFAOYSA-N
Mol Weight 439.27 g/mol
Molecular Formula C17H19BrN4O5
Exact Mass 438.053883 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8FAp22tlpL8
Name diethyl 1-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.053882723 u
Formula C17H19BrN4O5
InChI InChI=1S/C17H19BrN4O5/c1-4-26-16(24)14-15(17(25)27-5-2)22(21-20-14)9-13(23)19-11-6-7-12(18)10(3)8-11/h6-8H,4-5,9H2,1-3H3,(H,19,23)
InChIKey QPHDMOUGAKTPJI-UHFFFAOYSA-N
Molecular Weight 439.266 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6830
Solvent DMSO-d6
Source Vendor ID: NMR/12329257