CID 208528

32391-55-2

Structural Information

Molecular Formula
C20H22N2O3
SMILES
C1=CC=C(C=C1)C2=C(OC(=N2)CN(CCO)CCO)C3=CC=CC=C3
InChI
InChI=1S/C20H22N2O3/c23-13-11-22(12-14-24)15-18-21-19(16-7-3-1-4-8-16)20(25-18)17-9-5-2-6-10-17/h1-10,23-24H,11-15H2
InChIKey
IYKDDRQDLCCRLQ-UHFFFAOYSA-N
Compound name
2-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl-(2-hydroxyethyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

338.16306 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.17034 180.4
[M+Na]+ 361.15228 185.5
[M-H]- 337.15578 188.0
[M+NH4]+ 356.19688 191.4
[M+K]+ 377.12622 182.0
[M+H-H2O]+ 321.16032 170.8
[M+HCOO]- 383.16126 201.7
[M+CH3COO]- 397.17691 210.2
[M+Na-2H]- 359.13773 183.2
[M]+ 338.16251 182.6
[M]- 338.16361 182.6
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