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3-(1H-1,2,3,4-Tetrazol-1-yl)benzoic Acid
SpectraBase Compound ID 8YwSm1Uxfjm
InChI InChI=1S/C8H6N4O2/c13-8(14)6-2-1-3-7(4-6)12-5-9-10-11-12/h1-5H,(H,13,14)
InChIKey UNTMKIYQHROFCP-UHFFFAOYSA-N
Mol Weight 190.16 g/mol
Molecular Formula C8H6N4O2
Exact Mass 190.049075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYff1t7xzEC
Name 3-(1H-1,2,3,4-Tetrazol-1-yl)benzoic Acid
Comments Less than 3 mono-isotopic peaks
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Formula C8H6N4O2
InChI InChI=1S/C8H6N4O2/c13-8(14)6-2-1-3-7(4-6)12-5-9-10-11-12/h1-5H,(H,13,14)
InChIKey UNTMKIYQHROFCP-UHFFFAOYSA-N
Molecular Weight 190.162 g/mol
SMILES OC(c1cc(-[n]2nnnc2)ccc1)=O
SPLASH splash10-014i-9000000000-5cfe95e81cc71684c67a
Source of Spectrum U1-2011-2832-21
Synonyms 3-(1-tetrazolyl)benzoic acid 3-(1,2,3,4-tetrazol-1-yl)benzoic acid
Wiley ID 1665404