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2-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-nitro-1H-isoindole-1,3(2H)-dione

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2-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-nitro-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID H5KnIvqAutJ
InChI InChI=1S/C20H15BrN4O4/c1-11-18(12(2)23(22-11)10-13-6-8-14(21)9-7-13)24-19(26)15-4-3-5-16(25(28)29)17(15)20(24)27/h3-9H,10H2,1-2H3
InChIKey AEQZOHFQUQDAFK-UHFFFAOYSA-N
Mol Weight 455.27 g/mol
Molecular Formula C20H15BrN4O4
Exact Mass 454.027668 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BeYBJKeYdhe
Name 2-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-nitro-1H-isoindole-1,3(2H)-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H15BrN4O4/c1-11-18(12(2)23(22-11)10-13-6-8-14(21)9-7-13)24-19(26)15-4-3-5-16(25(28)29)17(15)20(24)27/h3-9H,10H2,1-2H3
InChIKey AEQZOHFQUQDAFK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32963
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1911813; SBI_ID: SBI-032967
Temperature 318 °C