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1H-pyrazole-3-acetic acid, 4,5-dihydro-1-(4-methoxyphenyl)-4-[1-[[2-(4-morpholinyl)ethyl]amino]ethylidene]-5-oxo-, methyl ester, (4Z)-
SpectraBase Compound ID 3BeG2eXOp7s
InChI InChI=1S/C21H28N4O5/c1-15(22-8-9-24-10-12-30-13-11-24)20-18(14-19(26)29-3)23-25(21(20)27)16-4-6-17(28-2)7-5-16/h4-7,22H,8-14H2,1-3H3/b20-15-
InChIKey JTUHNKFIOYIRDU-HKWRFOASSA-N
Mol Weight 416.48 g/mol
Molecular Formula C21H28N4O5
Exact Mass 416.20597 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6BWPpbdpmF1
Name 1H-pyrazole-3-acetic acid, 4,5-dihydro-1-(4-methoxyphenyl)-4-[1-[[2-(4-morpholinyl)ethyl]amino]ethylidene]-5-oxo-, methyl ester, (4Z)-
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/C21H28N4O5/c1-15(22-8-9-24-10-12-30-13-11-24)20-18(14-19(26)29-3)23-25(21(20)27)16-4-6-17(28-2)7-5-16/h4-7,22H,8-14H2,1-3H3/b20-15-
InChIKey JTUHNKFIOYIRDU-HKWRFOASSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_924
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: F06836; Labnumber: VGU-77671
Temperature 308 °C