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acetamide, 2-[[4-(2-propenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2,4,6-trimethylphenyl)-
SpectraBase Compound ID Ids7OttgYVj
InChI InChI=1S/C21H23N5OS/c1-5-9-26-20(17-7-6-8-22-12-17)24-25-21(26)28-13-18(27)23-19-15(3)10-14(2)11-16(19)4/h5-8,10-12H,1,9,13H2,2-4H3,(H,23,27)
InChIKey ZCZCGCZDGNSKNO-UHFFFAOYSA-N
Mol Weight 393.51 g/mol
Molecular Formula C21H23N5OS
Exact Mass 393.162332 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8ziAnbm1mFC
Name acetamide, 2-[[4-(2-propenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2,4,6-trimethylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 393.162331554 u
Formula C21H23N5OS
InChI InChI=1S/C21H23N5OS/c1-5-9-26-20(17-7-6-8-22-12-17)24-25-21(26)28-13-18(27)23-19-15(3)10-14(2)11-16(19)4/h5-8,10-12H,1,9,13H2,2-4H3,(H,23,27)
InChIKey ZCZCGCZDGNSKNO-UHFFFAOYSA-N
Molecular Weight 393.509 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16156
Solvent DMSO-d6
Source Vendor ID: NMR/11210024; Lab Info: SAD; Lab Number: 32