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]+ 366.25398 193.4
[M+Na]+ 388.23592 194.9
[M-H]- 364.23942 197.5
[M+NH4]+ 383.28052 199.7
[M+K]+ 404.20986 189.7
[M+H-H2O]+ 348.24396 179.9
[M+HCOO]- 410.24490 202.3
[M+CH3COO]- 424.26055 199.3
[M+Na-2H]- 386.22137 194.4
[M]+ 365.24615 187.5
[M]- 365.24725 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.