CID 200015

Benzimidazole, 2-(2-piperidinoethyl)-

Structural Information

Molecular Formula
C14H19N3
SMILES
C1CCN(CC1)CCC2=NC3=CC=CC=C3N2
InChI
InChI=1S/C14H19N3/c1-4-9-17(10-5-1)11-8-14-15-12-6-2-3-7-13(12)16-14/h2-3,6-7H,1,4-5,8-11H2,(H,15,16)
InChIKey
WHQOMIHMUVODCZ-UHFFFAOYSA-N
Compound name
2-(2-piperidin-1-ylethyl)-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

1
Patents

229.1579 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.165176 153.2
[M+Na]+ 252.147118 159.6
[M-H]- 228.150624 154.5
[M+NH4]+ 247.191723 168.8
[M+K]+ 268.121058 154.1
[M+H-H2O]+ 212.155160 143.6
[M+HCOO]- 274.156101 169.8
[M+CH3COO]- 288.171751 163.5
[M+Na-2H]- 250.132566 158.1
[M]+ 229.15735142 149.0
[M]- 229.15844858 149.0
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