CID 4246116

Azobenzene-4,4'-dicarbonyl dichloride

Structural Information

Molecular Formula
C14H8Cl2N2O2
SMILES
C1=CC(=CC=C1C(=O)Cl)N=NC2=CC=C(C=C2)C(=O)Cl
InChI
InChI=1S/C14H8Cl2N2O2/c15-13(19)9-1-5-11(6-2-9)17-18-12-7-3-10(4-8-12)14(16)20/h1-8H
InChIKey
ASOXKYGOZZTVHL-UHFFFAOYSA-N
Compound name
4-[(4-carbonochloridoylphenyl)diazenyl]benzoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

137
Patents

305.99628 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.00356 165.1
[M+Na]+ 328.98550 174.2
[M-H]- 304.98900 174.0
[M+NH4]+ 324.03010 181.8
[M+K]+ 344.95944 169.1
[M+H-H2O]+ 288.99354 158.3
[M+HCOO]- 350.99448 183.8
[M+CH3COO]- 365.01013 209.8
[M+Na-2H]- 326.97095 169.6
[M]+ 305.99573 170.5
[M]- 305.99683 170.5
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.