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1-[(4-tert-butylphenoxy)methyl]-N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1H-pyrazole-3-carboxamide
SpectraBase Compound ID AATitz82uki
InChI InChI=1S/C22H28N6O4/c1-15-20(28(30)31)16(2)27(24-15)13-11-23-21(29)19-10-12-26(25-19)14-32-18-8-6-17(7-9-18)22(3,4)5/h6-10,12H,11,13-14H2,1-5H3,(H,23,29)
InChIKey ULBRCKFCVXLEME-UHFFFAOYSA-N
Mol Weight 440.5 g/mol
Molecular Formula C22H28N6O4
Exact Mass 440.217203 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1EKxjENRMc
Name 1-[(4-tert-butylphenoxy)methyl]-N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1H-pyrazole-3-carboxamide
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/C22H28N6O4/c1-15-20(28(30)31)16(2)27(24-15)13-11-23-21(29)19-10-12-26(25-19)14-32-18-8-6-17(7-9-18)22(3,4)5/h6-10,12H,11,13-14H2,1-5H3,(H,23,29)
InChIKey ULBRCKFCVXLEME-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30144
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: 1689903; SBI_ID: SBI-030148
Temperature 318 °C