CID 23605

1-(4-chlorophenyl)-3,3-dimethyltriazene

Structural Information

Molecular Formula
C8H10ClN3
SMILES
CN(C)N=NC1=CC=C(C=C1)Cl
InChI
InChI=1S/C8H10ClN3/c1-12(2)11-10-8-5-3-7(9)4-6-8/h3-6H,1-2H3
InChIKey
JZGUQAMYFQKVSO-UHFFFAOYSA-N
Compound name
N-[(4-chlorophenyl)diazenyl]-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

2
Patents

183.05632 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.06360 137.7
[M+Na]+ 206.04554 146.0
[M-H]- 182.04904 145.6
[M+NH4]+ 201.09014 159.7
[M+K]+ 222.01948 144.8
[M+H-H2O]+ 166.05358 131.3
[M+HCOO]- 228.05452 164.7
[M+CH3COO]- 242.07017 195.1
[M+Na-2H]- 204.03099 146.1
[M]+ 183.05577 141.7
[M]- 183.05687 141.7
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