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6-(1,3-benzodioxol-5-yl)-3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
SpectraBase Compound ID 2ZR3KhOaev6
InChI InChI=1S/C17H14N6O2S/c1-2-10-11(3-1)18-19-15(10)16-20-21-17-23(16)22-12(7-26-17)9-4-5-13-14(6-9)25-8-24-13/h4-6H,1-3,7-8H2,(H,18,19)
InChIKey YEPKAFFSXHHTQM-UHFFFAOYSA-N
Mol Weight 366.4 g/mol
Molecular Formula C17H14N6O2S
Exact Mass 366.089895 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2KO3L2gqHQm
Name 6-(1,3-benzodioxol-5-yl)-3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-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/C17H14N6O2S/c1-2-10-11(3-1)18-19-15(10)16-20-21-17-23(16)22-12(7-26-17)9-4-5-13-14(6-9)25-8-24-13/h4-6H,1-3,7-8H2,(H,18,19)
InChIKey YEPKAFFSXHHTQM-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4124
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: E00812; Labnumber: GRES-31051; SBI_ID: SBI-004126
Temperature 308 °C