CID 202727

As-triazine, 5,6-diphenyl-3-phenoxy-

Structural Information

Molecular Formula
C21H15N3O
SMILES
C1=CC=C(C=C1)C2=C(N=NC(=N2)OC3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C21H15N3O/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-24-21(22-19)25-18-14-8-3-9-15-18/h1-15H
InChIKey
KIDYNQAPDBOURC-UHFFFAOYSA-N
Compound name
3-phenoxy-5,6-diphenyl-1,2,4-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

325.12152 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.12880 178.8
[M+Na]+ 348.11074 198.6
[M+NH4]+ 343.15534 187.4
[M+K]+ 364.08468 187.9
[M-H]- 324.11424 187.3
[M+Na-2H]- 346.09619 194.3
[M]+ 325.12097 184.4
[M]- 325.12207 184.4
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