CID 459041

2-phenyl-4-phenylazoanisole

Structural Information

Molecular Formula
C19H16N2O
SMILES
COC1=C(C=C(C=C1)N=NC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H16N2O/c1-22-19-13-12-17(21-20-16-10-6-3-7-11-16)14-18(19)15-8-4-2-5-9-15/h2-14H,1H3
InChIKey
NEFYHIPWYPVKMP-UHFFFAOYSA-N
Compound name
(4-methoxy-3-phenylphenyl)-phenyldiazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.12625 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.13353 166.7
[M+Na]+ 311.11547 173.7
[M-H]- 287.11897 178.9
[M+NH4]+ 306.16007 182.4
[M+K]+ 327.08941 169.5
[M+H-H2O]+ 271.12351 156.4
[M+HCOO]- 333.12445 196.0
[M+CH3COO]- 347.14010 179.4
[M+Na-2H]- 309.10092 174.7
[M]+ 288.12570 168.3
[M]- 288.12680 168.3
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

No patent data available for this compound.