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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 isopropyl ether
SpectraBase Compound ID E2Q6osAD0ys
InChI InChI=1S/C20H18N4O3S/c1-12(2)27-15-5-3-4-14(8-15)19-21-22-20-24(19)23-16(10-28-20)13-6-7-17-18(9-13)26-11-25-17/h3-9,12H,10-11H2,1-2H3
InChIKey LOSFOMYBNUOWMZ-UHFFFAOYSA-N
Mol Weight 394.45 g/mol
Molecular Formula C20H18N4O3S
Exact Mass 394.109962 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IfJHeoUMjKP
Name 3-[6-(1,3-benzodioxol-5-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]phenyl isopropyl 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/C20H18N4O3S/c1-12(2)27-15-5-3-4-14(8-15)19-21-22-20-24(19)23-16(10-28-20)13-6-7-17-18(9-13)26-11-25-17/h3-9,12H,10-11H2,1-2H3
InChIKey LOSFOMYBNUOWMZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27187
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: D75583; Labnumber: GRESKO-6010; SBI_ID: SBI-027191
Synonyms 6-(1,3-benzodioxol-5-yl)-3-(3-isopropoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Temperature 318 °C