CID 218455

Brn 0686995

Structural Information

Molecular Formula
C22H18N4
SMILES
CC1=CC=C(C=C1)N=NC2=C(N(N=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H18N4/c1-17-12-14-19(15-13-17)24-25-21-16-23-26(20-10-6-3-7-11-20)22(21)18-8-4-2-5-9-18/h2-16H,1H3
InChIKey
LTJFTRQWCGSCDS-UHFFFAOYSA-N
Compound name
(1,5-diphenylpyrazol-4-yl)-(4-methylphenyl)diazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.15314 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.16042 180.8
[M+Na]+ 361.14236 188.7
[M-H]- 337.14586 193.8
[M+NH4]+ 356.18696 193.3
[M+K]+ 377.11630 182.1
[M+H-H2O]+ 321.15040 168.4
[M+HCOO]- 383.15134 208.2
[M+CH3COO]- 397.16699 192.3
[M+Na-2H]- 359.12781 186.3
[M]+ 338.15259 181.7
[M]- 338.15369 181.7
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

No patent data available for this compound.