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5-({1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID GE1noB4leeZ
InChI InChI=1S/C25H25N3O3S/c1-15(2)18-9-8-16(3)12-22(18)31-11-10-28-14-17(19-6-4-5-7-21(19)28)13-20-23(29)26-25(32)27-24(20)30/h4-9,12-15H,10-11H2,1-3H3,(H2,26,27,29,30,32)
InChIKey LIBKXXSZOUDMGM-UHFFFAOYSA-N
Mol Weight 447.55 g/mol
Molecular Formula C25H25N3O3S
Exact Mass 447.161663 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FTzdYeH2pVd
Name 5-({1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C25H25N3O3S/c1-15(2)18-9-8-16(3)12-22(18)31-11-10-28-14-17(19-6-4-5-7-21(19)28)13-20-23(29)26-25(32)27-24(20)30/h4-9,12-15H,10-11H2,1-3H3,(H2,26,27,29,30,32)
InChIKey LIBKXXSZOUDMGM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15728
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: C75110; Labnumber: SPDEM-2069; SBI_ID: SBI-015731
Temperature 318 °C