CID 135486181

154825-62-4

Structural Information

Molecular Formula
C22H17N3O2
SMILES
COC1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=CC=C3)C4=CC=CC=C4O
InChI
InChI=1S/C22H17N3O2/c1-27-17-13-11-16(12-14-17)21-23-20(15-7-3-2-4-8-15)24-22(25-21)18-9-5-6-10-19(18)26/h2-14,26H,1H3
InChIKey
VARDNKCBWBOEBW-UHFFFAOYSA-N
Compound name
2-[4-(4-methoxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4415
Patents

355.13208 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.13936 187.7
[M+Na]+ 378.12130 207.0
[M+NH4]+ 373.16590 195.2
[M+K]+ 394.09524 197.2
[M-H]- 354.12480 195.4
[M+Na-2H]- 376.10675 201.3
[M]+ 355.13153 193.0
[M]- 355.13263 193.0
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