CID 160426

4-[(4-methoxyphenyl)amino]benzenediazonium

Structural Information

Molecular Formula
C13H12N3O
SMILES
COC1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N
InChI
InChI=1S/C13H12N3O/c1-17-13-8-6-11(7-9-13)15-10-2-4-12(16-14)5-3-10/h2-9,15H,1H3/q+1
InChIKey
VTTTXQSHPXIRJX-UHFFFAOYSA-N
Compound name
4-(4-methoxyanilino)benzenediazonium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

72
Patents

226.09804 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.10532 153.3
[M+Na]+ 249.08726 168.3
[M+NH4]+ 244.13186 159.8
[M+K]+ 265.06120 157.9
[M-H]- 225.09076 153.4
[M+Na-2H]- 247.07271 161.4
[M]+ 226.09749 155.1
[M]- 226.09859 155.1
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