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2,1,3-Benzothiadiazole

View entire compound with spectra: 37 NMR, 5 FTIR, 1 Raman, 1 UV-Vis, and 5 MS (GC)

2,1,3-Benzothiadiazole
SpectraBase Compound ID AE2h9HTVwp1
InChI InChI=1S/C6H4N2S/c1-2-4-6-5(3-1)7-9-8-6/h1-4H
InChIKey PDQRQJVPEFGVRK-UHFFFAOYSA-N
Mol Weight 136.17 g/mol
Molecular Formula C6H4N2S
Exact Mass 136.009519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J37vVOwWd6e
Name BENZO-2,1,3-THIADIAZOL
CAS Registry Number 273-13-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H4N2S
InChI InChI=1S/C6H4N2S/c1-2-4-6-5(3-1)7-9-8-6/h1-4H
InChIKey PDQRQJVPEFGVRK-UHFFFAOYSA-N
Literature Reference Author L.STEFANIAK
Literature Reference Citation ORG.MAGN.RES.,11,385(1978)
Literature Reference DOI 10.1002/mrc.1270110804
Molecular Weight 136.171 g/mol
Solvent ACETONE-D6
Source File Reference UNIW1790