CID 13211998

88810-14-4

Structural Information

Molecular Formula
C20H25N3O
SMILES
CC1CN(C2=C(O1)C=CC=N2)C(CN3CCCC3)C4=CC=CC=C4
InChI
InChI=1S/C20H25N3O/c1-16-14-23(20-19(24-16)10-7-11-21-20)18(15-22-12-5-6-13-22)17-8-3-2-4-9-17/h2-4,7-11,16,18H,5-6,12-15H2,1H3
InChIKey
KRKTVOBWDJVWRE-UHFFFAOYSA-N
Compound name
2-methyl-4-(1-phenyl-2-pyrrolidin-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

323.19977 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.20705 179.9
[M+Na]+ 346.18899 193.6
[M+NH4]+ 341.23359 188.2
[M+K]+ 362.16293 187.4
[M-H]- 322.19249 186.3
[M+Na-2H]- 344.17444 186.8
[M]+ 323.19922 183.7
[M]- 323.20032 183.7
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.