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N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-N-methyl-3-[(3-methyl-4-nitrophenoxy)methyl]benzamide
SpectraBase Compound ID 1e5NdIAVNs2
InChI InChI=1S/C22H23ClN4O4/c1-4-26-21(19(23)12-24-26)13-25(3)22(28)17-7-5-6-16(11-17)14-31-18-8-9-20(27(29)30)15(2)10-18/h5-12H,4,13-14H2,1-3H3
InChIKey XCFZYURKHCIUDN-UHFFFAOYSA-N
Mol Weight 442.9 g/mol
Molecular Formula C22H23ClN4O4
Exact Mass 442.140783 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5T1IAOYx2vi
Name N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-N-methyl-3-[(3-methyl-4-nitrophenoxy)methyl]benzamide
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/C22H23ClN4O4/c1-4-26-21(19(23)12-24-26)13-25(3)22(28)17-7-5-6-16(11-17)14-31-18-8-9-20(27(29)30)15(2)10-18/h5-12H,4,13-14H2,1-3H3
InChIKey XCFZYURKHCIUDN-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30177
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: 1708076; SBI_ID: SBI-030181
Temperature 306 °C