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TUSPQFBMQKZVAL-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

TUSPQFBMQKZVAL-UHFFFAOYSA-N
SpectraBase Compound ID IBzIpJ2tsQC
InChI InChI=1S/C8H6N8/c1-2-6(8-11-15-16-12-8)4-3-5(1)7-9-13-14-10-7/h1-4H,(H,9,10,13,14)(H,11,12,15,16)
InChIKey TUSPQFBMQKZVAL-UHFFFAOYSA-N
Mol Weight 214.19 g/mol
Molecular Formula C8H6N8
Exact Mass 214.071542 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3UeJb3yl0gJ
Name 1,4-DITETRAZOL-5-YLBENZENE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H6N8
InChI InChI=1S/C8H6N8/c1-2-6(8-11-15-16-12-8)4-3-5(1)7-9-13-14-10-7/h1-4H,(H,9,10,13,14)(H,11,12,15,16)
InChIKey TUSPQFBMQKZVAL-UHFFFAOYSA-N
Literature Reference Author P.A.BETHEL,M.S.HILL,M.F.MAHON,K.C.MOLLOY
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3507(1999)
Literature Reference DOI 10.1039/a905336k
Molecular Weight 214.189 g/mol
Solvent DMSO-D6