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ethanone, 1-phenyl-2-[(1-phenyl-1H-1,2,4-triazol-3-yl)thio]-
SpectraBase Compound ID Koo1YqX7VR1
InChI InChI=1S/C16H13N3OS/c20-15(13-7-3-1-4-8-13)11-21-16-17-12-19(18-16)14-9-5-2-6-10-14/h1-10,12H,11H2
InChIKey ZSHXFCOCMFWYNO-UHFFFAOYSA-N
Mol Weight 295.36 g/mol
Molecular Formula C16H13N3OS
Exact Mass 295.077933 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IocZK3gb9SU
Name ethanone, 1-phenyl-2-[(1-phenyl-1H-1,2,4-triazol-3-yl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.077933224 u
Formula C16H13N3OS
InChI InChI=1S/C16H13N3OS/c20-15(13-7-3-1-4-8-13)11-21-16-17-12-19(18-16)14-9-5-2-6-10-14/h1-10,12H,11H2
InChIKey ZSHXFCOCMFWYNO-UHFFFAOYSA-N
Molecular Weight 295.360 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13610
Solvent DMSO-d6
Source Vendor ID: ZI/10025989; Lab Info: PLU; Lab Number: FCI-477-0136