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ethanone, 1-[4-(3-chlorophenyl)-4,5-dihydro-1-phenyl-5-(2-thienyl)-1H-1,2,4-triazol-3-yl]-
SpectraBase Compound ID 3CgUMjexTiC
InChI InChI=1S/C20H16ClN3OS/c1-14(25)19-22-24(16-8-3-2-4-9-16)20(18-11-6-12-26-18)23(19)17-10-5-7-15(21)13-17/h2-13,20H,1H3
InChIKey QITGZKSVNRCXIT-UHFFFAOYSA-N
Mol Weight 381.88 g/mol
Molecular Formula C20H16ClN3OS
Exact Mass 381.070261 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JBBUFUFbIfU
Name ethanone, 1-[4-(3-chlorophenyl)-4,5-dihydro-1-phenyl-5-(2-thienyl)-1H-1,2,4-triazol-3-yl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.070261020 u
Formula C20H16ClN3OS
InChI InChI=1S/C20H16ClN3OS/c1-14(25)19-22-24(16-8-3-2-4-9-16)20(18-11-6-12-26-18)23(19)17-10-5-7-15(21)13-17/h2-13,20H,1H3
InChIKey QITGZKSVNRCXIT-UHFFFAOYSA-N
Molecular Weight 381.881 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8662
Solvent DMSO-d6
Source Vendor ID: NMR/10211115; Lab Info: LP; Lab Number: LP-3902037