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N-[1-(2,6-dichlorobenzyl)-1H-1,2,4-triazol-3-yl]-5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolecarboxamide
SpectraBase Compound ID 7uL7AKnhioo
InChI InChI=1S/C18H14Cl2N8O4/c1-10-12(7-26-6-11(5-22-26)28(30)31)16(25-32-10)17(29)23-18-21-9-27(24-18)8-13-14(19)3-2-4-15(13)20/h2-6,9H,7-8H2,1H3,(H,23,24,29)
InChIKey VBKKDGHCOZAEHB-UHFFFAOYSA-N
Mol Weight 477.27 g/mol
Molecular Formula C18H14Cl2N8O4
Exact Mass 476.051506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AQ4atbqD51l
Name N-[1-(2,6-dichlorobenzyl)-1H-1,2,4-triazol-3-yl]-5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolecarboxamide
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/C18H14Cl2N8O4/c1-10-12(7-26-6-11(5-22-26)28(30)31)16(25-32-10)17(29)23-18-21-9-27(24-18)8-13-14(19)3-2-4-15(13)20/h2-6,9H,7-8H2,1H3,(H,23,24,29)
InChIKey VBKKDGHCOZAEHB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32842
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: 1911638; SBI_ID: SBI-032846
Temperature 318 °C