CID 13203534

88809-70-5

Structural Information

Molecular Formula
C22H27N3O2
SMILES
CC1(C(=O)N(C2=C(O1)C=CC=N2)C(CN3CCCCC3)C4=CC=CC=C4)C
InChI
InChI=1S/C22H27N3O2/c1-22(2)21(26)25(20-19(27-22)12-9-13-23-20)18(17-10-5-3-6-11-17)16-24-14-7-4-8-15-24/h3,5-6,9-13,18H,4,7-8,14-16H2,1-2H3
InChIKey
IKYBCIRZUZHVGE-UHFFFAOYSA-N
Compound name
2,2-dimethyl-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

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.21761 192.3
[M+Na]+ 388.19955 196.6
[M-H]- 364.20305 197.6
[M+NH4]+ 383.24415 201.0
[M+K]+ 404.17349 192.2
[M+H-H2O]+ 348.20759 179.3
[M+HCOO]- 410.20853 202.1
[M+CH3COO]- 424.22418 199.4
[M+Na-2H]- 386.18500 194.2
[M]+ 365.20978 187.7
[M]- 365.21088 187.7
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.