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N-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolecarboxamide
SpectraBase Compound ID 9mFbAOly6wK
InChI InChI=1S/C14H14ClN7O4/c1-9-12(8-21-7-11(5-18-21)22(24)25)13(19-26-9)14(23)16-2-3-20-6-10(15)4-17-20/h4-7H,2-3,8H2,1H3,(H,16,23)
InChIKey NCQQVDJRENWXBC-UHFFFAOYSA-N
Mol Weight 379.76 g/mol
Molecular Formula C14H14ClN7O4
Exact Mass 379.07958 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FttBm3VkVar
Name N-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-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/C14H14ClN7O4/c1-9-12(8-21-7-11(5-18-21)22(24)25)13(19-26-9)14(23)16-2-3-20-6-10(15)4-17-20/h4-7H,2-3,8H2,1H3,(H,16,23)
InChIKey NCQQVDJRENWXBC-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31481
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: 1842897; SBI_ID: SBI-031485
Temperature 306 °C