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5-Azabenzimidazole
SpectraBase Compound ID Dy9RscejgJT
InChI InChI=1S/C6H5N3/c1-2-7-3-6-5(1)8-4-9-6/h1-4H,(H,8,9)
InChIKey UBOOKRVGOBKDMM-UHFFFAOYSA-N
Mol Weight 119.13 g/mol
Molecular Formula C6H5N3
Exact Mass 119.048347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GwBTWCsFOa
Name 5-Azabenzimidazole
CAS Registry Number 272-97-9
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 119.048347173 u
Formula C6H5N3
InChI InChI=1S/C6H5N3/c1-2-7-3-6-5(1)8-4-9-6/h1-4H,(H,8,9)
InChIKey UBOOKRVGOBKDMM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 119.127 g/mol
Nominal Mass 119 u
Quality 988
Retention Index 1780
SMILES C12=C(N=CN2)C=NC=C1
SPLASH splash10-014i-9500000000-63af2f2fdbcc4c9cbc5e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3,5-Diazaindole 1H-Imidazo(4,5-c)pyridine 3H-Imidazo[4,5-c]pyridine
Technique GC/MS
Wiley ID DD2024_009931