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acetamide, N-(4-acetylphenyl)-2-[[4-(2-propenyl)-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID JClHNP1eSXk
InChI InChI=1S/C19H18N4O2S2/c1-3-10-23-18(16-5-4-11-26-16)21-22-19(23)27-12-17(25)20-15-8-6-14(7-9-15)13(2)24/h3-9,11H,1,10,12H2,2H3,(H,20,25)
InChIKey LOBLXWASDGVETP-UHFFFAOYSA-N
Mol Weight 398.5 g/mol
Molecular Formula C19H18N4O2S2
Exact Mass 398.087118 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4x2TWHsCVZZ
Name acetamide, N-(4-acetylphenyl)-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 398.087118182 u
Formula C19H18N4O2S2
InChI InChI=1S/C19H18N4O2S2/c1-3-10-23-18(16-5-4-11-26-16)21-22-19(23)27-12-17(25)20-15-8-6-14(7-9-15)13(2)24/h3-9,11H,1,10,12H2,2H3,(H,20,25)
InChIKey LOBLXWASDGVETP-UHFFFAOYSA-N
Molecular Weight 398.499 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17804
Solvent DMSO-d6
Source Vendor ID: NMR/11240320; Lab Info: SAD; Lab Number: 64