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6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
SpectraBase Compound ID 52GeHjyF6cq
InChI InChI=1S/C17H11ClN4O2S/c18-12-3-1-2-11(6-12)16-19-20-17-22(16)21-13(8-25-17)10-4-5-14-15(7-10)24-9-23-14/h1-7H,8-9H2
InChIKey PVQHIQIKSHEYMK-UHFFFAOYSA-N
Mol Weight 370.81 g/mol
Molecular Formula C17H11ClN4O2S
Exact Mass 370.029124 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID COcdBu7OfIC
Name 6-(1,3-benzodioxol-5-yl)-3-(3-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
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/C17H11ClN4O2S/c18-12-3-1-2-11(6-12)16-19-20-17-22(16)21-13(8-25-17)10-4-5-14-15(7-10)24-9-23-14/h1-7H,8-9H2
InChIKey PVQHIQIKSHEYMK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19737
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: D14378; Labnumber: UDSG-01019; SBI_ID: SBI-019741
Temperature 318 °C