CID 209115

Benzimidazole, 1-((4-methylpiperidino)methyl)-, hydrochloride

Structural Information

Molecular Formula
C14H19N3
SMILES
CC1CCN(CC1)CN2C=NC3=CC=CC=C32
InChI
InChI=1S/C14H19N3/c1-12-6-8-16(9-7-12)11-17-10-15-13-4-2-3-5-14(13)17/h2-5,10,12H,6-9,11H2,1H3
InChIKey
HJEHXIMYZQEMGV-UHFFFAOYSA-N
Compound name
1-[(4-methylpiperidin-1-yl)methyl]benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.1579 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.165176 153.6
[M+Na]+ 252.147118 161.5
[M-H]- 228.150624 156.7
[M+NH4]+ 247.191723 170.3
[M+K]+ 268.121058 156.8
[M+H-H2O]+ 212.155160 144.0
[M+HCOO]- 274.156101 171.7
[M+CH3COO]- 288.171751 165.0
[M+Na-2H]- 250.132566 158.1
[M]+ 229.15735142 151.6
[M]- 229.15844858 151.6
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.