CID 4246116

10252-29-6

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: 168
Patents: 305.99628 Da
Monoisotopic Mass: 4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	307.00356	164.3
[M+Na]+	328.98550	179.3
[M+NH4]+	324.03010	172.7
[M+K]+	344.95944	170.9
[M-H]-	304.98900	169.6
[M+Na-2H]-	326.97095	174.0
[M]+	305.99573	168.5
[M]-	305.99683	168.5

Literature stripe

literature stripe

Patent stripe

patents stripe