CID 22475991

253158-13-3

Structural Information

Molecular Formula
C23H26ClN3
SMILES
CC(C)(C)C1=CC=C(C=C1)C2=NC(=NC(=N2)Cl)C3=CC=C(C=C3)C(C)(C)C
InChI
InChI=1S/C23H26ClN3/c1-22(2,3)17-11-7-15(8-12-17)19-25-20(27-21(24)26-19)16-9-13-18(14-10-16)23(4,5)6/h7-14H,1-6H3
InChIKey
NLAAIBGZDQFCAO-UHFFFAOYSA-N
Compound name
2,4-bis(4-tert-butylphenyl)-6-chloro-1,3,5-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

224
Patents

379.18152 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.18880 198.5
[M+Na]+ 402.17074 216.3
[M+NH4]+ 397.21534 206.0
[M+K]+ 418.14468 206.9
[M-H]- 378.17424 203.7
[M+Na-2H]- 400.15619 209.3
[M]+ 379.18097 203.3
[M]- 379.18207 203.3
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