CID 13203545

88809-80-7

Structural Information

Molecular Formula
C25H25N3O3
SMILES
C1COCCN1CC(C2=CC=CC=C2)N3C(=O)C(OC4=C3N=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C25H25N3O3/c29-25-23(20-10-5-2-6-11-20)31-22-12-7-13-26-24(22)28(25)21(19-8-3-1-4-9-19)18-27-14-16-30-17-15-27/h1-13,21,23H,14-18H2
InChIKey
RPQXNJIFQGIKMG-UHFFFAOYSA-N
Compound name
4-(2-morpholin-4-yl-1-phenylethyl)-2-phenylpyrido[3,2-b][1,4]oxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

415.1896 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 416.19688 202.6
[M+Na]+ 438.17882 205.5
[M-H]- 414.18232 210.8
[M+NH4]+ 433.22342 204.7
[M+K]+ 454.15276 201.3
[M+H-H2O]+ 398.18686 187.8
[M+HCOO]- 460.18780 211.4
[M+CH3COO]- 474.20345 208.4
[M+Na-2H]- 436.16427 204.3
[M]+ 415.18905 197.5
[M]- 415.19015 197.5
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.