CID 82483177

1-butyl-2-(piperidin-4-yl)-1h-1,3-benzodiazole dihydrochloride

Structural Information

Molecular Formula
C16H23N3
SMILES
CCCCN1C2=CC=CC=C2N=C1C3CCNCC3
InChI
InChI=1S/C16H23N3/c1-2-3-12-19-15-7-5-4-6-14(15)18-16(19)13-8-10-17-11-9-13/h4-7,13,17H,2-3,8-12H2,1H3
InChIKey
LNNATDIRWFLEOP-UHFFFAOYSA-N
Compound name
1-butyl-2-piperidin-4-ylbenzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

257.1892 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.19648 163.1
[M+Na]+ 280.17842 176.4
[M+NH4]+ 275.22302 171.5
[M+K]+ 296.15236 169.7
[M-H]- 256.18192 166.0
[M+Na-2H]- 278.16387 169.5
[M]+ 257.18865 165.8
[M]- 257.18975 165.8
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

patents stripe