CID 242786

2562-71-2

Structural Information

Molecular Formula
C15H15N3
SMILES
CN(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2
InChI
InChI=1S/C15H15N3/c1-18(2)12-9-7-11(8-10-12)15-16-13-5-3-4-6-14(13)17-15/h3-10H,1-2H3,(H,16,17)
InChIKey
ZKBBGUJBGLTNEK-UHFFFAOYSA-N
Compound name
4-(1H-benzimidazol-2-yl)-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

690
Patents

237.1266 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.133876 152.8
[M+Na]+ 260.115818 162.2
[M-H]- 236.119324 158.6
[M+NH4]+ 255.160423 170.5
[M+K]+ 276.089758 157.2
[M+H-H2O]+ 220.123860 144.1
[M+HCOO]- 282.124801 176.4
[M+CH3COO]- 296.140451 165.7
[M+Na-2H]- 258.101266 159.7
[M]+ 237.12605142 153.8
[M]- 237.12714858 153.8
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