CID 165588613

2728436-63-1

Structural Information

Molecular Formula
C19H23N3
SMILES
CCCCN1C2=C(C=C(C=C2)C3=CC=CC=C3)N=C1CCN
InChI
InChI=1S/C19H23N3/c1-2-3-13-22-18-10-9-16(15-7-5-4-6-8-15)14-17(18)21-19(22)11-12-20/h4-10,14H,2-3,11-13,20H2,1H3
InChIKey
RVUNQDCKZMTOIC-UHFFFAOYSA-N
Compound name
2-(1-butyl-5-phenylbenzimidazol-2-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.1892 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.19648 172.0
[M+Na]+ 316.17842 186.9
[M+NH4]+ 311.22302 180.5
[M+K]+ 332.15236 179.2
[M-H]- 292.18192 176.9
[M+Na-2H]- 314.16387 180.3
[M]+ 293.18865 175.6
[M]- 293.18975 175.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.