CID 88572

20503-78-0

Structural Information

Molecular Formula
C18H18N2O2
SMILES
CN(CCO)C1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H18N2O2/c1-20(12-13-21)18-19-16(14-8-4-2-5-9-14)17(22-18)15-10-6-3-7-11-15/h2-11,21H,12-13H2,1H3
InChIKey
KRSJARZIUCHGQS-UHFFFAOYSA-N
Compound name
2-[(4,5-diphenyl-1,3-oxazol-2-yl)-methylamino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.13684 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.144116 168.6
[M+Na]+ 317.126058 175.4
[M-H]- 293.129564 178.0
[M+NH4]+ 312.170663 182.3
[M+K]+ 333.099998 172.4
[M+H-H2O]+ 277.134100 159.4
[M+HCOO]- 339.135041 192.0
[M+CH3COO]- 353.150691 180.4
[M+Na-2H]- 315.111506 172.8
[M]+ 294.13629142 170.7
[M]- 294.13738858 170.7
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.