CID 1544511

Benzimidazole, 2-(3-(piperidino)propyl)-, hydrochloride, hydrate

Structural Information

Molecular Formula
C15H21N3
SMILES
C1CCN(CC1)CCCC2=NC3=CC=CC=C3N2
InChI
InChI=1S/C15H21N3/c1-4-10-18(11-5-1)12-6-9-15-16-13-7-2-3-8-14(13)17-15/h2-3,7-8H,1,4-6,9-12H2,(H,16,17)
InChIKey
HYGBHJLTBPTDMR-UHFFFAOYSA-N
Compound name
2-(3-piperidin-1-ylpropyl)-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

243.17355 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.180826 157.6
[M+Na]+ 266.162768 163.6
[M-H]- 242.166274 158.8
[M+NH4]+ 261.207373 172.7
[M+K]+ 282.136708 157.8
[M+H-H2O]+ 226.170810 147.8
[M+HCOO]- 288.171751 173.9
[M+CH3COO]- 302.187401 167.5
[M+Na-2H]- 264.148216 162.0
[M]+ 243.17300142 153.7
[M]- 243.17409858 153.7
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