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acetamide, N-(3-bromophenyl)-2-[[4-(2-propenyl)-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID GaPaTqgF5gk
InChI InChI=1S/C17H15BrN4OS2/c1-2-8-22-16(14-7-4-9-24-14)20-21-17(22)25-11-15(23)19-13-6-3-5-12(18)10-13/h2-7,9-10H,1,8,11H2,(H,19,23)
InChIKey LOBROXZGAJTWPV-UHFFFAOYSA-N
Mol Weight 435.36 g/mol
Molecular Formula C17H15BrN4OS2
Exact Mass 433.987066 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GEqU1d4YmxR
Name acetamide, N-(3-bromophenyl)-2-[[4-(2-propenyl)-5-(2-thienyl)-4H-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 433.987066466 u
Formula C17H15BrN4OS2
InChI InChI=1S/C17H15BrN4OS2/c1-2-8-22-16(14-7-4-9-24-14)20-21-17(22)25-11-15(23)19-13-6-3-5-12(18)10-13/h2-7,9-10H,1,8,11H2,(H,19,23)
InChIKey LOBROXZGAJTWPV-UHFFFAOYSA-N
Molecular Weight 435.358 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17803
Solvent DMSO-d6
Source Vendor ID: NMR/11240292; Lab Info: SAD; Lab Number: 29