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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fn3W1IwuYx
Name 1,2-dihydro-1,2,3,4-tetrazol-5-one
CAS Registry Number 16421-52-6
Comments Less than 3 mono-isotopic peaks
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Formula CH2N4O
InChI InChI=1S/CH2N4O/c6-1-2-4-5-3-1/h(H2,2,3,4,5,6)
InChIKey JXBKZAYVMSNKHA-UHFFFAOYSA-N
Molecular Weight 86.054 g/mol
SMILES N1NN=NC1=O
SPLASH splash10-000l-9000000000-b05aeb8a49c8e7b87644
Source of Spectrum J-47-480-0
Synonyms 1,2-dihydrotetrazol-5-one 1H-tetrazol-5-ol 5-Hydroxtetrazole 5-Hydroxytetrazole
Wiley ID 1116228