CID 74187

2-amino-1-methylbenzimidazole

Structural Information

Molecular Formula

C₈H₉N₃

SMILES

CN1C2=CC=CC=C2N=C1N

InChI

InChI=1S/C8H9N3/c1-11-7-5-3-2-4-6(7)10-8(11)9/h2-5H,1H3,(H2,9,10)

InChIKey

XDFZKQJLNGNJAN-UHFFFAOYSA-N

Compound name

1-methylbenzimidazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 11
References: 2196
Patents: 147.07965 Da
Monoisotopic Mass: 0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	148.08693	127.0
[M+Na]+	170.06887	140.8
[M+NH4]+	165.11347	136.2
[M+K]+	186.04281	136.1
[M-H]-	146.07237	129.3
[M+Na-2H]-	168.05432	134.5
[M]+	147.07910	129.6
[M]-	147.08020	129.6

Literature stripe

literature stripe

Patent stripe

patents stripe