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1-piperazinecarbothioamide, 4-[2-[[(2,6-dioxo-4-phenylcyclohexylidene)methyl]amino]ethyl]-N-ethyl-
SpectraBase Compound ID 47ns3GJVHPm
InChI InChI=1S/C22H30N4O2S/c1-2-24-22(29)26-12-10-25(11-13-26)9-8-23-16-19-20(27)14-18(15-21(19)28)17-6-4-3-5-7-17/h3-7,16,18,23H,2,8-15H2,1H3,(H,24,29)/b19-16-
InChIKey LDKFSYCYKPSZQT-MNDPQUGUSA-N
Mol Weight 414.57 g/mol
Molecular Formula C22H30N4O2S
Exact Mass 414.208947 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5wgoDanRC0s
Name 1-piperazinecarbothioamide, 4-[2-[[(2,6-dioxo-4-phenylcyclohexylidene)methyl]amino]ethyl]-N-ethyl-
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/C22H30N4O2S/c1-2-24-22(29)26-12-10-25(11-13-26)9-8-23-16-19-20(27)14-18(15-21(19)28)17-6-4-3-5-7-17/h3-7,16,18,23H,2,8-15H2,1H3,(H,24,29)/b19-16-
InChIKey LDKFSYCYKPSZQT-MNDPQUGUSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_1102
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: NMR/11228911