CID 80382

Benzenamine, 4-((4-aminophenyl)azo)-2-methoxy-5-methyl-

Structural Information

Molecular Formula
C14H16N4O
SMILES
CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)N)OC)N
InChI
InChI=1S/C14H16N4O/c1-9-7-12(16)14(19-2)8-13(9)18-17-11-5-3-10(15)4-6-11/h3-8H,15-16H2,1-2H3
InChIKey
DBENZRUFCCLWPP-UHFFFAOYSA-N
Compound name
4-[(4-aminophenyl)diazenyl]-2-methoxy-5-methylaniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

66
Patents

256.13242 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.13970 158.1
[M+Na]+ 279.12164 166.2
[M-H]- 255.12514 167.5
[M+NH4]+ 274.16624 175.2
[M+K]+ 295.09558 163.4
[M+H-H2O]+ 239.12968 149.3
[M+HCOO]- 301.13062 188.6
[M+CH3COO]- 315.14627 211.2
[M+Na-2H]- 277.10709 163.6
[M]+ 256.13187 158.3
[M]- 256.13297 158.3
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

patents stripe