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TETRAZOLONE;5-OXOTETRAZOLE

View entire compound with spectra: 4 NMR, and 1 MS (GC)

TETRAZOLONE;5-OXOTETRAZOLE
SpectraBase Compound ID LDAdppb0mot
InChI InChI=1S/CH2N4O/c6-1-2-4-5-3-1/h(H2,2,3,4,5,6)
InChIKey JXBKZAYVMSNKHA-UHFFFAOYSA-N
Mol Weight 86.05 g/mol
Molecular Formula CH2N4O
Exact Mass 86.022861 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8SvCWMtL7gk
Name TETRAZOLONE;5-OXOTETRAZOLE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula CH2N4O
InChI InChI=1S/CH2N4O/c6-1-2-4-5-3-1/h(H2,2,3,4,5,6)
InChIKey JXBKZAYVMSNKHA-UHFFFAOYSA-N
Literature Reference Author D.FISCHER,T.M.KLAPOETKE,J.STIERSTORFER
Literature Reference Citation PROP.EXPL.PYROT.,37,156(2012)
Literature Reference DOI 10.1002/prep.201100108
Molecular Weight 86.053 g/mol
Solvent DMSO-D6
Source File Reference UWLU78325