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7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-6-acetic acid, 3-(2-thienyl)-, ethyl ester
SpectraBase Compound ID KmaswBX7czs
InChI InChI=1S/C12H12N4O2S2/c1-2-18-10(17)6-8-7-20-12-14-13-11(16(12)15-8)9-4-3-5-19-9/h3-5H,2,6-7H2,1H3
InChIKey GMCWXHUWHFUMQH-UHFFFAOYSA-N
Mol Weight 308.37 g/mol
Molecular Formula C12H12N4O2S2
Exact Mass 308.040168 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EiP32W69yun
Name 7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-6-acetic acid, 3-(2-thienyl)-, ethyl ester
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/C12H12N4O2S2/c1-2-18-10(17)6-8-7-20-12-14-13-11(16(12)15-8)9-4-3-5-19-9/h3-5H,2,6-7H2,1H3
InChIKey GMCWXHUWHFUMQH-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_332
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: F03938; Labnumber: NNOBK-8366
Temperature 308 °C