CID 13203541

88809-76-1

Structural Information

Molecular Formula
C22H27N3O3
SMILES
CCCC1C(=O)N(C2=C(O1)C=CC=N2)C(CN3CCOCC3)C4=CC=CC=C4
InChI
InChI=1S/C22H27N3O3/c1-2-7-20-22(26)25(21-19(28-20)10-6-11-23-21)18(17-8-4-3-5-9-17)16-24-12-14-27-15-13-24/h3-6,8-11,18,20H,2,7,12-16H2,1H3
InChIKey
LXHGHXRVFXQZIP-UHFFFAOYSA-N
Compound name
4-(2-morpholin-4-yl-1-phenylethyl)-2-propylpyrido[3,2-b][1,4]oxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.20523 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.21251 195.1
[M+Na]+ 404.19445 209.1
[M+NH4]+ 399.23905 201.6
[M+K]+ 420.16839 201.7
[M-H]- 380.19795 202.3
[M+Na-2H]- 402.17990 200.6
[M]+ 381.20468 199.1
[M]- 381.20578 199.1
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.