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N-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]-N'-propylthiourea
SpectraBase Compound ID 93Dd9pxYv5S
InChI InChI=1S/C16H22N4S/c1-4-10-17-16(21)18-11-15-12(2)19-20(13(15)3)14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3,(H2,17,18,21)
InChIKey VHNXMKSRBNPNPP-UHFFFAOYSA-N
Mol Weight 302.44 g/mol
Molecular Formula C16H22N4S
Exact Mass 302.156518 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9khdnNUiXPR
Name N-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]-N'-propylthiourea
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/C16H22N4S/c1-4-10-17-16(21)18-11-15-12(2)19-20(13(15)3)14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3,(H2,17,18,21)
InChIKey VHNXMKSRBNPNPP-UHFFFAOYSA-N
NMR Offset 17.9127
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_29853
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: 1315565; SBI_ID: SBI-029857
Temperature 303 °C