CID 84304

4-chloro-2-nitrobenzenediazonium

Structural Information

Molecular Formula

C₆H₃ClN₃O₂

SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])[N+]#N

InChI

InChI=1S/C6H3ClN3O2/c7-4-1-2-5(9-8)6(3-4)10(11)12/h1-3H/q+1

InChIKey

PKGYYZYRNOVFKK-UHFFFAOYSA-N

Compound name

4-chloro-2-nitrobenzenediazonium

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 21
Patents: 183.99138 Da
Monoisotopic Mass: 2.9
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]+	184.99866	134.3
[M+Na]+	206.98060	149.7
[M+NH4]+	202.02520	140.9
[M+K]+	222.95454	143.0
[M-H]-	182.98410	132.9
[M+Na-2H]-	204.96605	140.3
[M]+	183.99083	135.8
[M]-	183.99193	135.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe