CID 4173126

4'-(dimethylamino)-3-methyl-4-nitroazobenzene

Structural Information

Molecular Formula
C15H16N4O2
SMILES
CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)N(C)C)[N+](=O)[O-]
InChI
InChI=1S/C15H16N4O2/c1-11-10-13(6-9-15(11)19(20)21)17-16-12-4-7-14(8-5-12)18(2)3/h4-10H,1-3H3
InChIKey
HNNTWHZGLGXPPS-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-[(3-methyl-4-nitrophenyl)diazenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.12732 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.13460 164.0
[M+Na]+ 307.11654 169.9
[M-H]- 283.12004 174.9
[M+NH4]+ 302.16114 179.9
[M+K]+ 323.09048 164.7
[M+H-H2O]+ 267.12458 159.1
[M+HCOO]- 329.12552 195.5
[M+CH3COO]- 343.14117 211.6
[M+Na-2H]- 305.10199 171.6
[M]+ 284.12677 165.3
[M]- 284.12787 165.3
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.