CID 22352243

2-(4-biphenylyl)-4,6-dichloro-1,3,5-triazine

Structural Information

Molecular Formula
C15H9Cl2N3
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NC(=N3)Cl)Cl
InChI
InChI=1S/C15H9Cl2N3/c16-14-18-13(19-15(17)20-14)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
InChIKey
JYPGHMDTTDKUEL-UHFFFAOYSA-N
Compound name
2,4-dichloro-6-(4-phenylphenyl)-1,3,5-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

407
Patents

301.01736 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.02464 166.6
[M+Na]+ 324.00658 186.9
[M+NH4]+ 319.05118 175.9
[M+K]+ 339.98052 176.0
[M-H]- 300.01008 172.8
[M+Na-2H]- 321.99203 179.6
[M]+ 301.01681 172.2
[M]- 301.01791 172.2
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