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N-allyl-N'-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]thiourea
SpectraBase Compound ID HsjKBBy4IXg
InChI InChI=1S/C16H20N4S/c1-4-10-17-16(21)18-11-15-12(2)19-20(13(15)3)14-8-6-5-7-9-14/h4-9H,1,10-11H2,2-3H3,(H2,17,18,21)
InChIKey YLDZTPNFKMGKHV-UHFFFAOYSA-N
Mol Weight 300.42 g/mol
Molecular Formula C16H20N4S
Exact Mass 300.140868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JXSfWjjNB50
Name N-allyl-N'-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]thiourea
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H20N4S/c1-4-10-17-16(21)18-11-15-12(2)19-20(13(15)3)14-8-6-5-7-9-14/h4-9H,1,10-11H2,2-3H3,(H2,17,18,21)
InChIKey YLDZTPNFKMGKHV-UHFFFAOYSA-N
NMR Offset 17.9135
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31771
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1843331; SBI_ID: SBI-031775
Temperature 303 °C