CID 116548

2,5-dimethoxy-4-(4-tolylazo)aniline

Structural Information

Molecular Formula
C15H17N3O2
SMILES
CC1=CC=C(C=C1)N=NC2=C(C=C(C(=C2)OC)N)OC
InChI
InChI=1S/C15H17N3O2/c1-10-4-6-11(7-5-10)17-18-13-9-14(19-2)12(16)8-15(13)20-3/h4-9H,16H2,1-3H3
InChIKey
VZMIFBBHAZJWEI-UHFFFAOYSA-N
Compound name
2,5-dimethoxy-4-[(4-methylphenyl)diazenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

271.13208 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.13936 163.2
[M+Na]+ 294.12130 176.4
[M+NH4]+ 289.16590 171.2
[M+K]+ 310.09524 168.9
[M-H]- 270.12480 169.8
[M+Na-2H]- 292.10675 172.3
[M]+ 271.13153 166.9
[M]- 271.13263 166.9
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