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3-(Para-methylphenyl)-1,2,4,5-tetrazin
SpectraBase Compound ID By5YWUJcMkF
InChI InChI=1S/C9H8N4/c1-7-2-4-8(5-3-7)9-12-10-6-11-13-9/h2-6H,1H3
InChIKey XMOHKSLFQKGAEW-UHFFFAOYSA-N
Mol Weight 172.19 g/mol
Molecular Formula C9H8N4
Exact Mass 172.074896 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 66BMufUt8Ec
Name 3-(PARA-METHYLPHENYL)-1,2,4,5-TETRAZIN
CAS Registry Number 37385-31-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8N4
InChI InChI=1S/C9H8N4/c1-7-2-4-8(5-3-7)9-12-10-6-11-13-9/h2-6H,1H3
InChIKey XMOHKSLFQKGAEW-UHFFFAOYSA-N
Literature Reference Author A.COUNOTTE-POTMAN,H.C.VANDERPLAS,B.VANVELDHUIZEN
Literature Reference Citation J.ORG.CHEM.,46,3805(1981)
Literature Reference DOI 10.1021/jo00332a008
Molecular Weight 172.189 g/mol
Solvent CDCl3
Source File Reference UNIW17405