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N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
SpectraBase Compound ID KCq6MMKtPAj
InChI InChI=1S/C25H19N5O3S/c1-16-2-11-22-23(12-16)34-25(28-22)19-7-9-20(10-8-19)27-24(31)18-5-3-17(4-6-18)14-29-15-21(13-26-29)30(32)33/h2-13,15H,14H2,1H3,(H,27,31)
InChIKey ASFJSEQEFPNIIH-UHFFFAOYSA-N
Mol Weight 469.52 g/mol
Molecular Formula C25H19N5O3S
Exact Mass 469.120861 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID bhkhoNZppG
Name N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-[(4-nitro-1H-pyrazol-1-yl)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/C25H19N5O3S/c1-16-2-11-22-23(12-16)34-25(28-22)19-7-9-20(10-8-19)27-24(31)18-5-3-17(4-6-18)14-29-15-21(13-26-29)30(32)33/h2-13,15H,14H2,1H3,(H,27,31)
InChIKey ASFJSEQEFPNIIH-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3882
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/9133419; Labnumber: BAC_UAMK/020233; UZI_ID: UZI-003884
Temperature 308 °C