CID 13203526

88809-62-5

Structural Information

Molecular Formula
C20H23N3O2
SMILES
C1CCN(CC1)CC(C2=CC=CC=C2)N3C(=O)COC4=C3N=CC=C4
InChI
InChI=1S/C20H23N3O2/c24-19-15-25-18-10-7-11-21-20(18)23(19)17(16-8-3-1-4-9-16)14-22-12-5-2-6-13-22/h1,3-4,7-11,17H,2,5-6,12-15H2
InChIKey
BRKCIQFAJIXKLV-UHFFFAOYSA-N
Compound name
4-(1-phenyl-2-piperidin-1-ylethyl)pyrido[3,2-b][1,4]oxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.17902 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.18630 182.2
[M+Na]+ 360.16824 185.3
[M-H]- 336.17174 187.0
[M+NH4]+ 355.21284 189.6
[M+K]+ 376.14218 180.8
[M+H-H2O]+ 320.17628 169.3
[M+HCOO]- 382.17722 192.6
[M+CH3COO]- 396.19287 189.3
[M+Na-2H]- 358.15369 185.0
[M]+ 337.17847 176.1
[M]- 337.17957 176.1
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.