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N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]-N'-(4-iodo-2-methylphenyl)thiourea
SpectraBase Compound ID K2GiiHyhxsx
InChI InChI=1S/C14H14ClIN4OS/c1-3-20-12(10(15)7-17-20)13(21)19-14(22)18-11-5-4-9(16)6-8(11)2/h4-7H,3H2,1-2H3,(H2,18,19,21,22)
InChIKey QNUPRGQXGURAHJ-UHFFFAOYSA-N
Mol Weight 448.71 g/mol
Molecular Formula C14H14ClIN4OS
Exact Mass 447.962155 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8jU1jRlCNA4
Name N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]-N'-(4-iodo-2-methylphenyl)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/C14H14ClIN4OS/c1-3-20-12(10(15)7-17-20)13(21)19-14(22)18-11-5-4-9(16)6-8(11)2/h4-7H,3H2,1-2H3,(H2,18,19,21,22)
InChIKey QNUPRGQXGURAHJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4521
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: 9680696; UBI_ID: UBI-004522
Temperature 308 °C