CID 76491

3073-87-8

Structural Information

Molecular Formula
C26H20N2O2
SMILES
CC1=C(OC(=N1)C2=CC=C(C=C2)C3=NC(=C(O3)C4=CC=CC=C4)C)C5=CC=CC=C5
InChI
InChI=1S/C26H20N2O2/c1-17-23(19-9-5-3-6-10-19)29-25(27-17)21-13-15-22(16-14-21)26-28-18(2)24(30-26)20-11-7-4-8-12-20/h3-16H,1-2H3
InChIKey
VLDFXDUAENINOO-UHFFFAOYSA-N
Compound name
4-methyl-2-[4-(4-methyl-5-phenyl-1,3-oxazol-2-yl)phenyl]-5-phenyl-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

866
Patents

392.15247 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.15975 194.0
[M+Na]+ 415.14169 214.2
[M+NH4]+ 410.18629 202.5
[M+K]+ 431.11563 208.2
[M-H]- 391.14519 206.7
[M+Na-2H]- 413.12714 207.4
[M]+ 392.15192 201.1
[M]- 392.15302 201.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe