CID 201123

3323-03-3

Structural Information

Molecular Formula

C₁₈H₁₉N₃O

SMILES

C1COCCN1CC2=C(N=C3N2C=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C18H19N3O/c1-2-6-15(7-3-1)18-16(14-20-10-12-22-13-11-20)21-9-5-4-8-17(21)19-18/h1-9H,10-14H2

InChIKey

IXMAJNIDZSUZTI-UHFFFAOYSA-N

Compound name

4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2
Patents: 293.1528 Da
Monoisotopic Mass: 2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	294.16008	168.2
[M+Na]+	316.14202	175.6
[M-H]-	292.14552	174.8
[M+NH4]+	311.18662	180.2
[M+K]+	332.11596	170.7
[M+H-H2O]+	276.15006	157.0
[M+HCOO]-	338.15100	185.3
[M+CH3COO]-	352.16665	178.6
[M+Na-2H]-	314.12747	173.1
[M]+	293.15225	166.7
[M]-	293.15335	166.7

Literature stripe

literature stripe

Patent stripe

patents stripe