CID 20784895

5-methoxy-6-methylbenzimidazole

Structural Information

Molecular Formula
C9H10N2O
SMILES
CC1=CC2=C(C=C1OC)N=CN2
InChI
InChI=1S/C9H10N2O/c1-6-3-7-8(11-5-10-7)4-9(6)12-2/h3-5H,1-2H3,(H,10,11)
InChIKey
NTRDUQMAJNJZAW-UHFFFAOYSA-N
Compound name
5-methoxy-6-methyl-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

50
Patents

162.07932 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.08660 131.6
[M+Na]+ 185.06854 145.8
[M+NH4]+ 180.11314 140.4
[M+K]+ 201.04248 141.0
[M-H]- 161.07204 132.8
[M+Na-2H]- 183.05399 138.5
[M]+ 162.07877 134.0
[M]- 162.07987 134.0
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