CID 24844891

88810-19-9

Structural Information

Molecular Formula
C21H27N3O2
SMILES
CCC1CN(C2=C(O1)C=CC=N2)C(CN3CCOCC3)C4=CC=CC=C4
InChI
InChI=1S/C21H27N3O2/c1-2-18-15-24(21-20(26-18)9-6-10-22-21)19(17-7-4-3-5-8-17)16-23-11-13-25-14-12-23/h3-10,18-19H,2,11-16H2,1H3
InChIKey
BJKGLLHDPRBWIX-UHFFFAOYSA-N
Compound name
2-ethyl-4-(2-morpholin-4-yl-1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.21033 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.217606 188.6
[M+Na]+ 376.199548 191.3
[M-H]- 352.203054 193.9
[M+NH4]+ 371.244153 194.2
[M+K]+ 392.173488 188.1
[M+H-H2O]+ 336.207590 175.6
[M+HCOO]- 398.208531 197.5
[M+CH3COO]- 412.224181 195.4
[M+Na-2H]- 374.184996 191.1
[M]+ 353.20978142 184.1
[M]- 353.21087858 184.1
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.