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propanedioic acid, 2-[[[3-(3-bromophenyl)-1H-pyrazol-5-yl]amino]methylene]-, diethyl ester
SpectraBase Compound ID EHQJVKsjL2g
InChI InChI=1S/C17H18BrN3O4/c1-3-24-16(22)13(17(23)25-4-2)10-19-15-9-14(20-21-15)11-6-5-7-12(18)8-11/h5-10H,3-4H2,1-2H3,(H2,19,20,21)
InChIKey ZJSASPKNTLVVFH-UHFFFAOYSA-N
Mol Weight 408.25 g/mol
Molecular Formula C17H18BrN3O4
Exact Mass 407.048069 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gvs7ndNpYT9
Name propanedioic acid, 2-[[[3-(3-bromophenyl)-1H-pyrazol-5-yl]amino]methylene]-, diethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.048069068 u
Formula C17H18BrN3O4
InChI InChI=1S/C17H18BrN3O4/c1-3-24-16(22)13(17(23)25-4-2)10-19-15-9-14(20-21-15)11-6-5-7-12(18)8-11/h5-10H,3-4H2,1-2H3,(H2,19,20,21)
InChIKey ZJSASPKNTLVVFH-UHFFFAOYSA-N
Molecular Weight 408.252 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4081
Solvent DMSO-d6
Source Vendor ID: NMR/9253003; Lab Info: LD; Lab Number: LD-2300012
Temperature 29.85 °C