CID 13211994

88810-10-0

Structural Information

Molecular Formula
C19H23N3O
SMILES
C1CCN(C1)CC(C2=CC=CC=C2)N3CCOC4=C3N=CC=C4
InChI
InChI=1S/C19H23N3O/c1-2-7-16(8-3-1)17(15-21-11-4-5-12-21)22-13-14-23-18-9-6-10-20-19(18)22/h1-3,6-10,17H,4-5,11-15H2
InChIKey
JFJVMPWNXFIVCX-UHFFFAOYSA-N
Compound name
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

309.1841 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.19138 173.9
[M+Na]+ 332.17332 177.4
[M-H]- 308.17682 179.2
[M+NH4]+ 327.21792 184.6
[M+K]+ 348.14726 173.3
[M+H-H2O]+ 292.18136 162.3
[M+HCOO]- 354.18230 186.8
[M+CH3COO]- 368.19795 182.3
[M+Na-2H]- 330.15877 175.9
[M]+ 309.18355 168.9
[M]- 309.18465 168.9
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.