CID 7575

4-(phenylazo)diphenylamine

Structural Information

Molecular Formula
C18H15N3
SMILES
C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC=CC=C3
InChI
InChI=1S/C18H15N3/c1-3-7-15(8-4-1)19-16-11-13-18(14-12-16)21-20-17-9-5-2-6-10-17/h1-14,19H
InChIKey
VXLFYNFOITWQPM-UHFFFAOYSA-N
Compound name
N-phenyl-4-phenyldiazenylaniline
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

2
References

1300
Patents

273.1266 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.13388 160.9
[M+Na]+ 296.11582 166.7
[M-H]- 272.11932 172.8
[M+NH4]+ 291.16042 176.6
[M+K]+ 312.08976 162.1
[M+H-H2O]+ 256.12386 150.7
[M+HCOO]- 318.12480 191.4
[M+CH3COO]- 332.14045 173.4
[M+Na-2H]- 294.10127 170.9
[M]+ 273.12605 159.9
[M]- 273.12715 159.9
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