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3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(1H-indol-2-ylmethyl)benzamide
SpectraBase Compound ID IDj5Q80stSm
InChI InChI=1S/C22H21N5O3/c1-14-21(27(29)30)15(2)26(25-14)13-16-6-5-8-18(10-16)22(28)23-12-19-11-17-7-3-4-9-20(17)24-19/h3-11,24H,12-13H2,1-2H3,(H,23,28)
InChIKey LFXLAJREJKPKLV-UHFFFAOYSA-N
Mol Weight 403.44 g/mol
Molecular Formula C22H21N5O3
Exact Mass 403.16444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5nulYj3CHUQ
Name 3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(1H-indol-2-ylmethyl)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/C22H21N5O3/c1-14-21(27(29)30)15(2)26(25-14)13-16-6-5-8-18(10-16)22(28)23-12-19-11-17-7-3-4-9-20(17)24-19/h3-11,24H,12-13H2,1-2H3,(H,23,28)
InChIKey LFXLAJREJKPKLV-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16976
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: UZI/1026671; Labnumber: SAP5097; UZI_ID: UZI-016980
Temperature 308 °C