CID 97046956

1400191-57-2

Structural Information

Molecular Formula
C27H25N3
SMILES
CN1C(N(C2=CC=CC=C21)C)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C27H25N3/c1-28-25-15-9-10-16-26(25)29(2)27(28)21-17-19-24(20-18-21)30(22-11-5-3-6-12-22)23-13-7-4-8-14-23/h3-20,27H,1-2H3
InChIKey
YUDZJTFIRBVGFN-UHFFFAOYSA-N
Compound name
4-(1,3-dimethyl-2H-benzimidazol-2-yl)-N,N-diphenylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

54
Patents

391.20483 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.21211 199.1
[M+Na]+ 414.19405 217.2
[M+NH4]+ 409.23865 208.8
[M+K]+ 430.16799 207.7
[M-H]- 390.19755 209.6
[M+Na-2H]- 412.17950 212.0
[M]+ 391.20428 205.1
[M]- 391.20538 205.1
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