CID 17846

2851-13-0

Structural Information

Molecular Formula
C9H11N3
SMILES
CN(C)C1=NC2=CC=CC=C2N1
InChI
InChI=1S/C9H11N3/c1-12(2)9-10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3,(H,10,11)
InChIKey
NMTCCVZABWWGSB-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1H-benzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

85
Patents

161.09529 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.10257 131.7
[M+Na]+ 184.08451 141.5
[M-H]- 160.08801 134.4
[M+NH4]+ 179.12911 152.8
[M+K]+ 200.05845 138.9
[M+H-H2O]+ 144.09255 124.6
[M+HCOO]- 206.09349 155.9
[M+CH3COO]- 220.10914 145.9
[M+Na-2H]- 182.06996 140.2
[M]+ 161.09474 132.8
[M]- 161.09584 132.8
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