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1-benzhydryl-3-nitro-5-phenoxy-1H-1,2,4-triazole

View entire compound with spectra: 1 NMR

1-benzhydryl-3-nitro-5-phenoxy-1H-1,2,4-triazole
SpectraBase Compound ID pn1QAU3R9r
InChI InChI=1S/C21H16N4O3/c26-25(27)20-22-21(28-18-14-8-3-9-15-18)24(23-20)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,19H
InChIKey CHBPQSNFUKJIJK-UHFFFAOYSA-N
Mol Weight 372.38 g/mol
Molecular Formula C21H16N4O3
Exact Mass 372.12224 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5LfhLCZtEg9
Name 1-benzhydryl-3-nitro-5-phenoxy-1H-1,2,4-triazole
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/C21H16N4O3/c26-25(27)20-22-21(28-18-14-8-3-9-15-18)24(23-20)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,19H
InChIKey CHBPQSNFUKJIJK-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6505
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: D14992; Labnumber: TOLST-0262; SBI_ID: SBI-006508
Synonyms 1-benzhydryl-3-nitro-1H-1,2,4-triazol-5-yl phenyl ether
Temperature 306 °C