CID 13203532

88809-68-1

Structural Information

Molecular Formula
C20H25N3O2
SMILES
CCN(CC)CC(C1=CC=CC=C1)N2C(=O)C(OC3=C2N=CC=C3)C
InChI
InChI=1S/C20H25N3O2/c1-4-22(5-2)14-17(16-10-7-6-8-11-16)23-19-18(12-9-13-21-19)25-15(3)20(23)24/h6-13,15,17H,4-5,14H2,1-3H3
InChIKey
LAUAUWBHYFETBK-UHFFFAOYSA-N
Compound name
4-[2-(diethylamino)-1-phenylethyl]-2-methylpyrido[3,2-b][1,4]oxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.19467 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.20195 184.8
[M+Na]+ 362.18389 190.0
[M-H]- 338.18739 190.6
[M+NH4]+ 357.22849 195.2
[M+K]+ 378.15783 187.3
[M+H-H2O]+ 322.19193 173.8
[M+HCOO]- 384.19287 201.3
[M+CH3COO]- 398.20852 219.6
[M+Na-2H]- 360.16934 187.7
[M]+ 339.19412 186.4
[M]- 339.19522 186.4
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.