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2-{[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID 45zpoiHSG6g
InChI InChI=1S/C19H13N5O3S/c1-27-12-8-6-11(7-9-12)16-20-21-19-24(16)22-15(28-19)10-23-17(25)13-4-2-3-5-14(13)18(23)26/h2-9H,10H2,1H3
InChIKey DIXNPGUUIWISFD-UHFFFAOYSA-N
Mol Weight 391.41 g/mol
Molecular Formula C19H13N5O3S
Exact Mass 391.07391 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AkJqSax3Qch
Name 2-{[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-1H-isoindole-1,3(2H)-dione
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/C19H13N5O3S/c1-27-12-8-6-11(7-9-12)16-20-21-19-24(16)22-15(28-19)10-23-17(25)13-4-2-3-5-14(13)18(23)26/h2-9H,10H2,1H3
InChIKey DIXNPGUUIWISFD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27205
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: D75604; Labnumber: GRESKO-6032; SBI_ID: SBI-027209
Temperature 318 °C