For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
ethyl 1-methyl-3-{[4-(2-toluidinosulfonyl)anilino]carbonyl}-1H-pyrazole-5-carboxylate
SpectraBase Compound ID ESbr9bMreE7
InChI InChI=1S/C21H22N4O5S/c1-4-30-21(27)19-13-18(23-25(19)3)20(26)22-15-9-11-16(12-10-15)31(28,29)24-17-8-6-5-7-14(17)2/h5-13,24H,4H2,1-3H3,(H,22,26)
InChIKey HBCKBRLSSDTUQB-UHFFFAOYSA-N
Mol Weight 442.49 g/mol
Molecular Formula C21H22N4O5S
Exact Mass 442.131091 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 59M2OrO21FF
Name ethyl 1-methyl-3-{[4-(2-toluidinosulfonyl)anilino]carbonyl}-1H-pyrazole-5-carboxylate
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/C21H22N4O5S/c1-4-30-21(27)19-13-18(23-25(19)3)20(26)22-15-9-11-16(12-10-15)31(28,29)24-17-8-6-5-7-14(17)2/h5-13,24H,4H2,1-3H3,(H,22,26)
InChIKey HBCKBRLSSDTUQB-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10804
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: UZI/1030835; Labnumber: MEI0166; UZI_ID: UZI-010806
Temperature 308 °C