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N-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}-N'-(4-ethoxy-2-nitrophenyl)thiourea
SpectraBase Compound ID EhB0ThB0KlF
InChI InChI=1S/C18H16ClN5O5S/c1-2-28-12-3-5-14(15(7-12)24(26)27)21-18(30)22-17(25)16-6-4-13(29-16)10-23-9-11(19)8-20-23/h3-9H,2,10H2,1H3,(H2,21,22,25,30)
InChIKey VYCRVXSAOPYATQ-UHFFFAOYSA-N
Mol Weight 449.87 g/mol
Molecular Formula C18H16ClN5O5S
Exact Mass 449.056068 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JdlNr0P8fQk
Name N-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}-N'-(4-ethoxy-2-nitrophenyl)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/C18H16ClN5O5S/c1-2-28-12-3-5-14(15(7-12)24(26)27)21-18(30)22-17(25)16-6-4-13(29-16)10-23-9-11(19)8-20-23/h3-9H,2,10H2,1H3,(H2,21,22,25,30)
InChIKey VYCRVXSAOPYATQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6701
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: 9686225; UBI_ID: UBI-006703
Temperature 318 °C