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1H-indole, 3-[3-[(2,4-dichlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-
SpectraBase Compound ID BXprmtU8nIa
InChI InChI=1S/C18H11Cl2N5OS/c19-10-5-6-15(13(20)7-10)26-9-16-22-23-18-25(16)24-17(27-18)12-8-21-14-4-2-1-3-11(12)14/h1-8,21H,9H2
InChIKey XIIITEXUTVYTNS-UHFFFAOYSA-N
Mol Weight 416.29 g/mol
Molecular Formula C18H11Cl2N5OS
Exact Mass 415.006137 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8hpK4dBRHDu
Name 1H-indole, 3-[3-[(2,4-dichlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-
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/C18H11Cl2N5OS/c19-10-5-6-15(13(20)7-10)26-9-16-22-23-18-25(16)24-17(27-18)12-8-21-14-4-2-1-3-11(12)14/h1-8,21H,9H2
InChIKey XIIITEXUTVYTNS-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_7962
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: F31350; Labnumber: BAL4-8538