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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(phenylmethyl)-, (6Z)-
SpectraBase Compound ID 3KQVMhsOWDx
InChI InChI=1S/C30H28N4O4S/c1-3-36-26-18-22(12-13-25(26)38-15-14-37-23-11-7-8-20(2)16-23)17-24-28(31)34-30(32-29(24)35)39-27(33-34)19-21-9-5-4-6-10-21/h4-13,16-18,31H,3,14-15,19H2,1-2H3/b24-17-,31-28?
InChIKey GNUWLPILAHLJJA-WRLNMTLESA-N
Mol Weight 540.64 g/mol
Molecular Formula C30H28N4O4S
Exact Mass 540.183127 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KTsDvK14Gjf
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(phenylmethyl)-, (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/C30H28N4O4S/c1-3-36-26-18-22(12-13-25(26)38-15-14-37-23-11-7-8-20(2)16-23)17-24-28(31)34-30(32-29(24)35)39-27(33-34)19-21-9-5-4-6-10-21/h4-13,16-18,31H,3,14-15,19H2,1-2H3/b24-17-,31-28?
InChIKey GNUWLPILAHLJJA-WRLNMTLESA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2541
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/11269206