CID 214446

33161-96-5

Structural Information

Molecular Formula
C21H22N2O2
SMILES
C1COCCN1CCC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C21H22N2O2/c1-3-7-17(8-4-1)20-21(18-9-5-2-6-10-18)25-19(22-20)11-12-23-13-15-24-16-14-23/h1-10H,11-16H2
InChIKey
HLLXCEVAVHLQTH-UHFFFAOYSA-N
Compound name
4-[2-(4,5-diphenyl-1,3-oxazol-2-yl)ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

334.16812 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.17540 180.0
[M+Na]+ 357.15734 185.1
[M-H]- 333.16084 190.2
[M+NH4]+ 352.20194 188.8
[M+K]+ 373.13128 181.7
[M+H-H2O]+ 317.16538 168.9
[M+HCOO]- 379.16632 196.8
[M+CH3COO]- 393.18197 189.7
[M+Na-2H]- 355.14279 182.3
[M]+ 334.16757 178.2
[M]- 334.16867 178.2
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

patents stripe