CID 595193

1622-58-8

Structural Information

Molecular Formula
C9H11N3
SMILES
CCN1C2=CC=CC=C2N=C1N
InChI
InChI=1S/C9H11N3/c1-2-12-8-6-4-3-5-7(8)11-9(12)10/h3-6H,2H2,1H3,(H2,10,11)
InChIKey
AQOCOHSUICOLQL-UHFFFAOYSA-N
Compound name
1-ethylbenzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

47
Patents

161.09529 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.10257 131.6
[M+Na]+ 184.08451 145.2
[M+NH4]+ 179.12911 140.6
[M+K]+ 200.05845 140.2
[M-H]- 160.08801 133.9
[M+Na-2H]- 182.06996 138.8
[M]+ 161.09474 134.1
[M]- 161.09584 134.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe