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2H-1,2,3-triazole-4-carboxamide, 5-[[[[1-(3-chloro-4-methylphenyl)-1H-tetrazol-5-yl]thio]acetyl]amino]-2-phenyl-
SpectraBase Compound ID 4vI02nebC2S
InChI InChI=1S/C19H16ClN9O2S/c1-11-7-8-13(9-14(11)20)28-19(23-26-27-28)32-10-15(30)22-18-16(17(21)31)24-29(25-18)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H2,21,31)(H,22,25,30)
InChIKey OERFVTGPLOLGOM-UHFFFAOYSA-N
Mol Weight 469.91 g/mol
Molecular Formula C19H16ClN9O2S
Exact Mass 469.08362 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6BlyVNCyFct
Name 2H-1,2,3-triazole-4-carboxamide, 5-[[[[1-(3-chloro-4-methylphenyl)-1H-tetrazol-5-yl]thio]acetyl]amino]-2-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 469.083619663 u
Formula C19H16ClN9O2S
InChI InChI=1S/C19H16ClN9O2S/c1-11-7-8-13(9-14(11)20)28-19(23-26-27-28)32-10-15(30)22-18-16(17(21)31)24-29(25-18)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H2,21,31)(H,22,25,30)
InChIKey OERFVTGPLOLGOM-UHFFFAOYSA-N
Molecular Weight 469.911 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16157
Solvent DMSO-d6
Source Vendor ID: NMR/11210025; Lab Info: SAD; Lab Number: 33