CID 66851

4-nitrobenzenediazonium

Structural Information

Molecular Formula
C6H4N3O2
SMILES
C1=CC(=CC=C1[N+]#N)[N+](=O)[O-]
InChI
InChI=1S/C6H4N3O2/c7-8-5-1-3-6(4-2-5)9(10)11/h1-4H/q+1
InChIKey
ICMFHHGKLRTCBM-UHFFFAOYSA-N
Compound name
4-nitrobenzenediazonium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

25
References

1815
Patents

150.03035 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.03763 131.6
[M+Na]+ 173.01957 145.9
[M+NH4]+ 168.06417 137.9
[M+K]+ 188.99351 139.7
[M-H]- 149.02307 130.1
[M+Na-2H]- 171.00502 137.5
[M]+ 150.02980 132.6
[M]- 150.03090 132.6
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