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3-[6-(1,3-benzodioxol-5-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]phenyl methyl ether
SpectraBase Compound ID JaI8KEKikBB
InChI InChI=1S/C18H14N4O3S/c1-23-13-4-2-3-12(7-13)17-19-20-18-22(17)21-14(9-26-18)11-5-6-15-16(8-11)25-10-24-15/h2-8H,9-10H2,1H3
InChIKey ZQXXSYYDEMPVNE-UHFFFAOYSA-N
Mol Weight 366.4 g/mol
Molecular Formula C18H14N4O3S
Exact Mass 366.078661 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8OQf4z66eVc
Name 3-[6-(1,3-benzodioxol-5-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]phenyl methyl ether
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/C18H14N4O3S/c1-23-13-4-2-3-12(7-13)17-19-20-18-22(17)21-14(9-26-18)11-5-6-15-16(8-11)25-10-24-15/h2-8H,9-10H2,1H3
InChIKey ZQXXSYYDEMPVNE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19766
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: D14407; Labnumber: UDSG-01103; SBI_ID: SBI-019770
Synonyms 6-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Temperature 318 °C