CID 3076951

3-(2-ethoxyethyl)-2-(1-methylpiperidin-4-yl)-3h-imidazo(4,5-b)pyridine hemitrifumarate

Structural Information

Molecular Formula
C16H26N4O
SMILES
CCOCCN1C(NC2=C1C=CC=N2)C3CCN(CC3)C
InChI
InChI=1S/C16H26N4O/c1-3-21-12-11-20-14-5-4-8-17-15(14)18-16(20)13-6-9-19(2)10-7-13/h4-5,8,13,16H,3,6-7,9-12H2,1-2H3,(H,17,18)
InChIKey
BYFRTZASYQWXRP-UHFFFAOYSA-N
Compound name
1-(2-ethoxyethyl)-2-(1-methylpiperidin-4-yl)-2,3-dihydroimidazo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.21066 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.21794 174.0
[M+Na]+ 313.19988 179.2
[M-H]- 289.20338 173.6
[M+NH4]+ 308.24448 186.0
[M+K]+ 329.17382 174.0
[M+H-H2O]+ 273.20792 163.4
[M+HCOO]- 335.20886 185.7
[M+CH3COO]- 349.22451 182.0
[M+Na-2H]- 311.18533 174.1
[M]+ 290.21011 170.3
[M]- 290.21121 170.3
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.