CID 13212009

88808-33-7

Structural Information

Molecular Formula
C23H31N3O
SMILES
CCCC1CN(C2=C(O1)C=CC=N2)C(CN3CCCCC3)C4=CC=CC=C4
InChI
InChI=1S/C23H31N3O/c1-2-10-20-17-26(23-22(27-20)13-9-14-24-23)21(19-11-5-3-6-12-19)18-25-15-7-4-8-16-25/h3,5-6,9,11-14,20-21H,2,4,7-8,10,15-18H2,1H3
InChIKey
PFYNEMAPVSZJAX-UHFFFAOYSA-N
Compound name
4-(1-phenyl-2-piperidin-1-ylethyl)-2-propyl-2,3-dihydropyrido[3,2-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.2467 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.253976 193.4
[M+Na]+ 388.235918 194.9
[M-H]- 364.239424 197.5
[M+NH4]+ 383.280523 199.7
[M+K]+ 404.209858 189.7
[M+H-H2O]+ 348.243960 179.9
[M+HCOO]- 410.244901 202.3
[M+CH3COO]- 424.260551 199.3
[M+Na-2H]- 386.221366 194.4
[M]+ 365.24615142 187.5
[M]- 365.24724858 187.5
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.