CID 201120

Imidazo(1,2-a)pyridine, 2-(p-nitrophenyl)-3-(piperidinomethyl)-

Structural Information

Molecular Formula
C19H20N4O2
SMILES
C1CCN(CC1)CC2=C(N=C3N2C=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]
InChI
InChI=1S/C19H20N4O2/c24-23(25)16-9-7-15(8-10-16)19-17(14-21-11-3-1-4-12-21)22-13-5-2-6-18(22)20-19/h2,5-10,13H,1,3-4,11-12,14H2
InChIKey
FZZVGFOLHUCHOZ-UHFFFAOYSA-N
Compound name
2-(4-nitrophenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.15863 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.165906 178.3
[M+Na]+ 359.147848 183.4
[M-H]- 335.151354 184.6
[M+NH4]+ 354.192453 188.8
[M+K]+ 375.121788 173.4
[M+H-H2O]+ 319.155890 171.1
[M+HCOO]- 381.156831 196.6
[M+CH3COO]- 395.172481 204.5
[M+Na-2H]- 357.133296 183.8
[M]+ 336.15808142 174.1
[M]- 336.15917858 174.1
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.