CID 5463277

1,3,5-triphenylformazan

Structural Information

Molecular Formula
C19H16N4
SMILES
C1=CC=C(C=C1)/C(=N\NC2=CC=CC=C2)/N=NC3=CC=CC=C3
InChI
InChI=1S/C19H16N4/c1-4-10-16(11-5-1)19(22-20-17-12-6-2-7-13-17)23-21-18-14-8-3-9-15-18/h1-15,20H/b22-19+,23-21?
InChIKey
BEIHVSJTPTXQGB-QIXACUJNSA-N
Compound name
N'-anilino-N-phenyliminobenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

328
Patents

300.13748 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.14476 168.1
[M+Na]+ 323.12670 172.1
[M-H]- 299.13020 180.8
[M+NH4]+ 318.17130 182.6
[M+K]+ 339.10064 168.2
[M+H-H2O]+ 283.13474 157.0
[M+HCOO]- 345.13568 199.8
[M+CH3COO]- 359.15133 179.8
[M+Na-2H]- 321.11215 178.0
[M]+ 300.13693 166.7
[M]- 300.13803 166.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe