CID 13212005

88810-20-2

Structural Information

Molecular Formula
C22H29N3O
SMILES
CCC1CN(C2=C(O1)C=CC=N2)C(CN3CCCCC3)C4=CC=CC=C4
InChI
InChI=1S/C22H29N3O/c1-2-19-16-25(22-21(26-19)12-9-13-23-22)20(18-10-5-3-6-11-18)17-24-14-7-4-8-15-24/h3,5-6,9-13,19-20H,2,4,7-8,14-17H2,1H3
InChIKey
OMOGTPUDYSLECP-UHFFFAOYSA-N
Compound name
2-ethyl-4-(1-phenyl-2-piperidin-1-ylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.23105 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.23833 189.8
[M+Na]+ 374.22027 204.1
[M+NH4]+ 369.26487 197.9
[M+K]+ 390.19421 195.1
[M-H]- 350.22377 196.8
[M+Na-2H]- 372.20572 197.1
[M]+ 351.23050 193.9
[M]- 351.23160 193.9
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.