CID 326318

Nsc297358

Structural Information

Molecular Formula
C18H15FN2O
SMILES
C1C2=C(C3=C(C=CC=N3)C=C2)OCN1CC4=CC=C(C=C4)F
InChI
InChI=1S/C18H15FN2O/c19-16-7-3-13(4-8-16)10-21-11-15-6-5-14-2-1-9-20-17(14)18(15)22-12-21/h1-9H,10-12H2
InChIKey
FHPBKNQCEHBSSL-UHFFFAOYSA-N
Compound name
3-[(4-fluorophenyl)methyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.11685 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.12413 167.9
[M+Na]+ 317.10607 176.4
[M-H]- 293.10957 172.4
[M+NH4]+ 312.15067 180.8
[M+K]+ 333.08001 171.0
[M+H-H2O]+ 277.11411 156.3
[M+HCOO]- 339.11505 182.8
[M+CH3COO]- 353.13070 178.2
[M+Na-2H]- 315.09152 175.3
[M]+ 294.11630 165.8
[M]- 294.11740 165.8
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.