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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[3-iodo-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl]methylene]-2-(1-methylethyl)-, (6Z)-
SpectraBase Compound ID 69eGeDBsKJS
InChI InChI=1S/C25H25IN4O5S/c1-14(2)24-29-30-22(27)16(23(31)28-25(30)36-24)11-15-12-17(26)21(20(13-15)33-4)35-10-9-34-19-8-6-5-7-18(19)32-3/h5-8,11-14,27H,9-10H2,1-4H3/b16-11-,27-22?
InChIKey VTHUPLLYOJSULX-OZFLQLRCSA-N
Mol Weight 620.46 g/mol
Molecular Formula C25H25IN4O5S
Exact Mass 620.059036 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FtJ3yWCRlPy
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[3-iodo-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl]methylene]-2-(1-methylethyl)-, (6Z)-
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/C25H25IN4O5S/c1-14(2)24-29-30-22(27)16(23(31)28-25(30)36-24)11-15-12-17(26)21(20(13-15)33-4)35-10-9-34-19-8-6-5-7-18(19)32-3/h5-8,11-14,27H,9-10H2,1-4H3/b16-11-,27-22?
InChIKey VTHUPLLYOJSULX-OZFLQLRCSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_261
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/10318748