CID 87058

2-chlorobenzenediazonium

Structural Information

Molecular Formula
C6H4ClN2
SMILES
C1=CC=C(C(=C1)[N+]#N)Cl
InChI
InChI=1S/C6H4ClN2/c7-5-3-1-2-4-6(5)9-8/h1-4H/q+1
InChIKey
HGOUHLGJFUPVGS-UHFFFAOYSA-N
Compound name
2-chlorobenzenediazonium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

131
Patents

139.0063 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.01358 122.9
[M+Na]+ 161.99552 138.6
[M+NH4]+ 157.04012 130.7
[M+K]+ 177.96946 128.8
[M-H]- 137.99902 121.1
[M+Na-2H]- 159.98097 130.6
[M]+ 139.00575 124.6
[M]- 139.00685 124.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe