CID 56843254

88799-25-1

Structural Information

Molecular Formula
C25H29N3O
SMILES
CCN(CC)CCN1C(C(OC2=C1N=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C25H29N3O/c1-3-27(4-2)18-19-28-23(20-12-7-5-8-13-20)24(21-14-9-6-10-15-21)29-22-16-11-17-26-25(22)28/h5-17,23-24H,3-4,18-19H2,1-2H3
InChIKey
TXSIJDGJUKJSTA-UHFFFAOYSA-N
Compound name
2-(2,3-diphenyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

387.23105 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.238326 199.2
[M+Na]+ 410.220268 203.5
[M-H]- 386.223774 207.3
[M+NH4]+ 405.264873 207.0
[M+K]+ 426.194208 198.4
[M+H-H2O]+ 370.228310 186.1
[M+HCOO]- 432.229251 215.6
[M+CH3COO]- 446.244901 207.1
[M+Na-2H]- 408.205716 202.6
[M]+ 387.23050142 199.3
[M]- 387.23159858 199.3
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.