CID 110490

5-chloro-2-methylbenzenediazonium

Structural Information

Molecular Formula
C7H6ClN2
SMILES
CC1=C(C=C(C=C1)Cl)[N+]#N
InChI
InChI=1S/C7H6ClN2/c1-5-2-3-6(8)4-7(5)10-9/h2-4H,1H3/q+1
InChIKey
RRSHLAWSHRGHTL-UHFFFAOYSA-N
Compound name
5-chloro-2-methylbenzenediazonium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

153.02196 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.02924 130.7
[M+Na]+ 176.01118 142.9
[M-H]- 152.01468 135.9
[M+NH4]+ 171.05578 151.0
[M+K]+ 191.98512 134.5
[M+H-H2O]+ 136.01922 122.2
[M+HCOO]- 198.02016 149.9
[M+CH3COO]- 212.03581 186.6
[M+Na-2H]- 173.99663 139.8
[M]+ 153.02141 127.2
[M]- 153.02251 127.2
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

patents stripe