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Methanone, (4-methoxyphenyl)(4,5-dihydro-4-methyl-5-thioxo-1H-1,2,4-triazol-1-yl)

View entire compound with spectra: 1 NMR, and 2 MS (GC)

Methanone, (4-methoxyphenyl)(4,5-dihydro-4-methyl-5-thioxo-1H-1,2,4-triazol-1-yl)
SpectraBase Compound ID A5em9jNEmdA
InChI InChI=1S/C11H11N3O2S/c1-13-7-12-14(11(13)17)10(15)8-3-5-9(16-2)6-4-8/h3-7H,1-2H3
InChIKey PSQFTNDVFLJXPV-UHFFFAOYSA-N
Mol Weight 249.29 g/mol
Molecular Formula C11H11N3O2S
Exact Mass 249.057198 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fy9Vdcce7Tz
Name 3H-1,2,4-triazole-3-thione, 2,4-dihydro-2-(4-methoxybenzoyl)-4-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.057197778 u
Formula C11H11N3O2S
InChI InChI=1S/C11H11N3O2S/c1-13-7-12-14(11(13)17)10(15)8-3-5-9(16-2)6-4-8/h3-7H,1-2H3
InChIKey PSQFTNDVFLJXPV-UHFFFAOYSA-N
Molecular Weight 249.288 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10599
Solvent DMSO-d6
Source Vendor ID: NMR/10251940; Lab Info: LP; Lab Number: LP-0302200