CID 13203538

88809-74-9

Structural Information

Molecular Formula
C22H27N3O2
SMILES
CCC1C(=O)N(C2=C(O1)C=CC=N2)C(CN3CCCCC3)C4=CC=CC=C4
InChI
InChI=1S/C22H27N3O2/c1-2-19-22(26)25(21-20(27-19)12-9-13-23-21)18(17-10-5-3-6-11-17)16-24-14-7-4-8-15-24/h3,5-6,9-13,18-19H,2,4,7-8,14-16H2,1H3
InChIKey
YPORWZFFRLLIII-UHFFFAOYSA-N
Compound name
2-ethyl-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

365.21033 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.21761 192.0
[M+Na]+ 388.19955 195.1
[M-H]- 364.20305 196.8
[M+NH4]+ 383.24415 198.5
[M+K]+ 404.17349 190.3
[M+H-H2O]+ 348.20759 178.9
[M+HCOO]- 410.20853 201.7
[M+CH3COO]- 424.22418 198.6
[M+Na-2H]- 386.18500 192.9
[M]+ 365.20978 187.0
[M]- 365.21088 187.0
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.