CID 675225

4-(2-phenylquinazolin-4-yl)morpholine

Structural Information

Molecular Formula
C18H17N3O
SMILES
C1COCCN1C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4
InChI
InChI=1S/C18H17N3O/c1-2-6-14(7-3-1)17-19-16-9-5-4-8-15(16)18(20-17)21-10-12-22-13-11-21/h1-9H,10-13H2
InChIKey
LELHZGOHVCQBJP-UHFFFAOYSA-N
Compound name
4-(2-phenylquinazolin-4-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

12
Patents

291.13718 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.14446 169.7
[M+Na]+ 314.12640 187.1
[M+NH4]+ 309.17100 178.8
[M+K]+ 330.10034 177.8
[M-H]- 290.12990 177.5
[M+Na-2H]- 312.11185 180.2
[M]+ 291.13663 174.7
[M]- 291.13773 174.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe