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]+ 388.23833 199.2
[M+Na]+ 410.22027 203.5
[M-H]- 386.22377 207.3
[M+NH4]+ 405.26487 207.0
[M+K]+ 426.19421 198.4
[M+H-H2O]+ 370.22831 186.1
[M+HCOO]- 432.22925 215.6
[M+CH3COO]- 446.24490 207.1
[M+Na-2H]- 408.20572 202.6
[M]+ 387.23050 199.3
[M]- 387.23160 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.