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ethyl 2-{[3-(4-methyl-1-piperidinyl)-2-quinoxalinyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID wtq6wx58zs
InChI InChI=1S/C25H30N4O2S/c1-3-31-25(30)21-17-8-4-7-11-20(17)32-24(21)28-22-23(29-14-12-16(2)13-15-29)27-19-10-6-5-9-18(19)26-22/h5-6,9-10,16H,3-4,7-8,11-15H2,1-2H3,(H,26,28)
InChIKey BXMBLYULYGKROO-UHFFFAOYSA-N
Mol Weight 450.6 g/mol
Molecular Formula C25H30N4O2S
Exact Mass 450.208947 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2FSeHn5rCPL
Name ethyl 2-{[3-(4-methyl-1-piperidinyl)-2-quinoxalinyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-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/C25H30N4O2S/c1-3-31-25(30)21-17-8-4-7-11-20(17)32-24(21)28-22-23(29-14-12-16(2)13-15-29)27-19-10-6-5-9-18(19)26-22/h5-6,9-10,16H,3-4,7-8,11-15H2,1-2H3,(H,26,28)
InChIKey BXMBLYULYGKROO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_2712
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: 110213; Labnumber: EXP04Sav102775; VK_ID: VK-002713
Temperature 318 °C