CID 201159

3369-04-8

Structural Information

Molecular Formula
C18H18N4O3
SMILES
C1COCCN1CC2=C(N=C3N2C=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]
InChI
InChI=1S/C18H18N4O3/c23-22(24)15-6-4-14(5-7-15)18-16(13-20-9-11-25-12-10-20)21-8-2-1-3-17(21)19-18/h1-8H,9-13H2
InChIKey
HAGZUEIRBSWOCR-UHFFFAOYSA-N
Compound name
4-[[2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.13788 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.14516 177.0
[M+Na]+ 361.12710 182.6
[M-H]- 337.13060 184.1
[M+NH4]+ 356.17170 186.0
[M+K]+ 377.10104 174.3
[M+H-H2O]+ 321.13514 170.0
[M+HCOO]- 383.13608 194.9
[M+CH3COO]- 397.15173 203.9
[M+Na-2H]- 359.11255 183.6
[M]+ 338.13733 174.4
[M]- 338.13843 174.4
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.